-
3
-
-
84857446182
-
The future of molecular dynamics simulations in drug discovery
-
D.W. Borhani, and D.E. Shaw The future of molecular dynamics simulations in drug discovery J. Comput.-Aided Mol. Des. 26 2012 15 26
-
(2012)
J. Comput.-Aided Mol. Des.
, vol.26
, pp. 15-26
-
-
Borhani, D.W.1
Shaw, D.E.2
-
5
-
-
5244275439
-
Stochastic dynamics simulations of macromolecular diffusion in a model of the cytoplasm of Escherichia coli
-
D.J. Bicout, and M.J. Field Stochastic dynamics simulations of macromolecular diffusion in a model of the cytoplasm of Escherichia coli J. Phys. Chem. 100 1996 2489 2497 (Pubitemid 126793198)
-
(1996)
Journal of Physical Chemistry
, vol.100
, Issue.7
, pp. 2489-2497
-
-
Bicout, D.J.1
Field, M.J.2
-
6
-
-
43849103490
-
Coarse-grained molecular simulation of diffusion and reaction kinetics in a crowded virtual cytoplasm
-
D. Ridgway, G. Broderick, A. Lopez-Campistrous, M. Ruaini, P. Winter, and M. Hamilton Coarse-grained molecular simulation of diffusion and reaction kinetics in a crowded virtual cytoplasm Biophys. J. 94 2008 3748 3759
-
(2008)
Biophys. J.
, vol.94
, pp. 3748-3759
-
-
Ridgway, D.1
Broderick, G.2
Lopez-Campistrous, A.3
Ruaini, M.4
Winter, P.5
Hamilton, M.6
-
7
-
-
77950792003
-
Diffusion crowding & protein stability in a dynamic molecular model of the bacterial cytoplasm
-
S.R. McGuffee, and A.H. Elcock Diffusion crowding & protein stability in a dynamic molecular model of the bacterial cytoplasm PLoS Comput. Biol. 6 2010 e1000694
-
(2010)
PLoS Comput. Biol.
, vol.6
, pp. 1000694
-
-
McGuffee, S.R.1
Elcock, A.H.2
-
8
-
-
78649876151
-
Crowding and hydrodynamic interactions likely dominate in vivo macromolecular motion
-
T. Ando, and J. Skolnick Crowding and hydrodynamic interactions likely dominate in vivo macromolecular motion PNAS 107 2010 18457 18462
-
(2010)
PNAS
, vol.107
, pp. 18457-18462
-
-
Ando, T.1
Skolnick, J.2
-
9
-
-
79251640891
-
An inventory of the bacterial macromolecular components and their spatial organization
-
A. Vendeville, D. Lariviere, and E. Fourmentin An inventory of the bacterial macromolecular components and their spatial organization FEMS Microbiol. Rev. 35 2011 395 414
-
(2011)
FEMS Microbiol. Rev.
, vol.35
, pp. 395-414
-
-
Vendeville, A.1
Lariviere, D.2
Fourmentin, E.3
-
10
-
-
0021381587
-
Properties and metabolism of the aqueous cytoplasm and its boundaries
-
J.S. Clegg Properties and metabolism of the aqueous cytoplasm and its boundaries Am. J. Physiol. - Reg. I. 246 1984 R133 R151
-
(1984)
Am. J. Physiol. - Reg. I.
, vol.246
-
-
Clegg, J.S.1
-
11
-
-
49749095639
-
Lipids and membrane protein structures
-
C. Hunte, and S. Richers Lipids and membrane protein structures Curr. Opin. Struct. Biol. 18 2008 406 411
-
(2008)
Curr. Opin. Struct. Biol.
, vol.18
, pp. 406-411
-
-
Hunte, C.1
Richers, S.2
-
12
-
-
14844304655
-
The new bacterial cell biology: Moving parts and subcellular architecture
-
DOI 10.1016/j.cell.2005.02.026
-
Z. Gitai The new bacterial cell biology: moving parts and subcellular architecture Cell 120 2005 577 586 (Pubitemid 40343071)
-
(2005)
Cell
, vol.120
, Issue.5
, pp. 577-586
-
-
Gitai, Z.1
-
14
-
-
79951888750
-
Protein folding landscapes in the living cell
-
S. Ebbinghaus, and M. Gruebele Protein folding landscapes in the living cell J. Phys. Chem. Lett. 2 2011 314 319
-
(2011)
J. Phys. Chem. Lett.
, vol.2
, pp. 314-319
-
-
Ebbinghaus, S.1
Gruebele, M.2
-
15
-
-
41049090929
-
Macromolecular crowding confinement: Biochemical biophysical and potential physiological consequences
-
H.-X. Zhou, G. Rivas, and A.P. Minton Macromolecular crowding confinement: biochemical biophysical and potential physiological consequences Annu. Rev. Biophys. 37 2008 375 397
-
(2008)
Annu. Rev. Biophys.
, vol.37
, pp. 375-397
-
-
Zhou, H.-X.1
Rivas, G.2
Minton, A.P.3
-
16
-
-
36749103188
-
Protein folding in confined and crowded environments
-
H.X. Zhou Protein folding in confined and crowded environments Arch. Biochem. Biophys. 469 2008 76 82
-
(2008)
Arch. Biochem. Biophys.
, vol.469
, pp. 76-82
-
-
Zhou, H.X.1
-
17
-
-
84876034428
-
Influences of crowded cellular environments on protein folding binding, and oligomerization: Biological consequences and potentials of atomistic modeling
-
H.-X. Zhou Influences of crowded cellular environments on protein folding binding, and oligomerization: biological consequences and potentials of atomistic modeling FEBS Lett. 587 2013 1053 1061
-
(2013)
FEBS Lett.
, vol.587
, pp. 1053-1061
-
-
Zhou, H.-X.1
-
19
-
-
79952526173
-
Power-law dependence of the melting temperature of ubiquitin on the volume fraction of macromolecular crowders
-
M.M. Waegele, and F. Gai Power-law dependence of the melting temperature of ubiquitin on the volume fraction of macromolecular crowders J. Chem. Phys. 134 2011 095104
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 095104
-
-
Waegele, M.M.1
Gai, F.2
-
20
-
-
33750720952
-
A simple semiempirical model for the effect of molecular confinement upon the rate of protein folding
-
DOI 10.1021/bi061597j
-
M. Hayer-Hartl, and A.P. Minton A simple semiempirical model for the effect of molecular confinement upon the rate of protein folding Biochemistry 45 2006 13356 13360 (Pubitemid 44707695)
-
(2006)
Biochemistry
, vol.45
, Issue.44
, pp. 13356-13360
-
-
Hayer-Hartl, M.1
Minton, A.P.2
-
21
-
-
84985735713
-
Excluded volume as a determinant of macromolecular structure and reactivity
-
A.P. Minton Excluded volume as a determinant of macromolecular structure and reactivity Biopolymers 20 1981 2093 2120
-
(1981)
Biopolymers
, vol.20
, pp. 2093-2120
-
-
Minton, A.P.1
-
22
-
-
84877069692
-
Effects of macromolecular crowding agents on protein folding in vitro and in silico
-
A. Christiansen, Q. Wang, M.S. Cheung, and P. Wittung-Stafshede Effects of macromolecular crowding agents on protein folding in vitro and in silico Biophys. Rev. 5 2013 137 145
-
(2013)
Biophys. Rev.
, vol.5
, pp. 137-145
-
-
Christiansen, A.1
Wang, Q.2
Cheung, M.S.3
Wittung-Stafshede, P.4
-
23
-
-
84878595500
-
A simple quantitative model of macromolecular crowding effects on protein folding: Application to the murine prion protein (121-231)
-
F. Bergasa-Caceres, and H.A. Rabitz A simple quantitative model of macromolecular crowding effects on protein folding: application to the murine prion protein (121-231) Chem. Phys. Lett. 574 2013 112 115
-
(2013)
Chem. Phys. Lett.
, vol.574
, pp. 112-115
-
-
Bergasa-Caceres, F.1
Rabitz, H.A.2
-
24
-
-
72049125389
-
Kirkwood-Buff theory of molecular and protein association, aggregation, and cellular crowding
-
M.B. Gee, and P.E. Smith Kirkwood-Buff theory of molecular and protein association, aggregation, and cellular crowding J. Chem. Phys. 131 2009 165101
-
(2009)
J. Chem. Phys.
, vol.131
, pp. 165101
-
-
Gee, M.B.1
Smith, P.E.2
-
25
-
-
84871205477
-
A method for computing association rate constants of atomistically represented proteins under macromolecular crowding
-
S.B. Qin, L. Cai, and H.X. Zhou A method for computing association rate constants of atomistically represented proteins under macromolecular crowding Phys. Biol. 9 2012 066008
-
(2012)
Phys. Biol.
, vol.9
, pp. 066008
-
-
Qin, S.B.1
Cai, L.2
Zhou, H.X.3
-
26
-
-
79951803064
-
Effects of polydisperse crowders on aggregation reactions: A molecular thermodynamic analysis
-
D. Shah, A.L. Tan, V. Ramakrishnan, J.W. Jiang, and R. Rajagopalan Effects of polydisperse crowders on aggregation reactions: a molecular thermodynamic analysis J. Chem. Phys. 134 2011 064704
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 064704
-
-
Shah, D.1
Tan, A.L.2
Ramakrishnan, V.3
Jiang, J.W.4
Rajagopalan, R.5
-
27
-
-
0019890347
-
Evidence for protein self-association induced by excluded volume myoglobin in the presence of globular-proteins
-
J. Wilf, and A.P. Minton Evidence for protein self-association induced by excluded volume myoglobin in the presence of globular-proteins Biochim. Biophys. Acta 670 1981 316 322
-
(1981)
Biochim. Biophys. Acta
, vol.670
, pp. 316-322
-
-
Wilf, J.1
Minton, A.P.2
-
28
-
-
0026730739
-
Confinement as a determinant of macromolecular structure and reactivity
-
A.P. Minton Confinement as a determinant of macromolecular structure and reactivity Biophys. J. 63 1992 1090 1100
-
(1992)
Biophys. J.
, vol.63
, pp. 1090-1100
-
-
Minton, A.P.1
-
29
-
-
79960962805
-
The effect of macromolecular crowding ionic strength and calcium binding on calmodulin dynamics
-
Q. Wang, K.C. Liang, A. Czader, M.N. Waxham, and M.S. Cheung The effect of macromolecular crowding ionic strength and calcium binding on calmodulin dynamics PLoS Comput. Biol. 7 2011 e1002114
-
(2011)
PLoS Comput. Biol.
, vol.7
, pp. 1002114
-
-
Wang, Q.1
Liang, K.C.2
Czader, A.3
Waxham, M.N.4
Cheung, M.S.5
-
30
-
-
84870015758
-
Effects of molecular crowding on the dynamics of intrinsically disordered proteins
-
E.A. Cino, M. Karttunen, and W.Y. Choy Effects of molecular crowding on the dynamics of intrinsically disordered proteins PLoS One 7 2012 e49876
-
(2012)
PLoS One
, vol.7
, pp. 49876
-
-
Cino, E.A.1
Karttunen, M.2
Choy, W.Y.3
-
31
-
-
63049088713
-
Crowding effects on the structural transitions in a flexible helical homopolymer
-
A. Kudlay, M.S. Cheung, and D. Thirumalai Crowding effects on the structural transitions in a flexible helical homopolymer Phys. Rev. Lett. 102 2009 118101
-
(2009)
Phys. Rev. Lett.
, vol.102
, pp. 118101
-
-
Kudlay, A.1
Cheung, M.S.2
Thirumalai, D.3
-
32
-
-
84874843784
-
Reduced native state stability in crowded cellular environment due to protein-protein interactions
-
R. Harada, N. Tochio, T. Kigawa, Y. Sugita, and M. Feig Reduced native state stability in crowded cellular environment due to protein-protein interactions J. Am. Chem. Soc. 135 2013 3696 3701
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 3696-3701
-
-
Harada, R.1
Tochio, N.2
Kigawa, T.3
Sugita, Y.4
Feig, M.5
-
33
-
-
84855848788
-
Variable interactions between protein crowders and biomolecular solutes are important in understanding cellular crowding
-
M. Feig, and Y. Sugita Variable interactions between protein crowders and biomolecular solutes are important in understanding cellular crowding J. Phys. Chem. B 116 2012 599 605
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 599-605
-
-
Feig, M.1
Sugita, Y.2
-
35
-
-
0027136282
-
Comparative protein modelling by satisfaction of spatial restraints
-
DOI 10.1006/jmbi.1993.1626
-
A. Sali, and T.L. Blundell Comparative protein modelling by satisfaction of spatial restraints J. Mol. Biol. 234 1993 779 815 (Pubitemid 24007801)
-
(1993)
Journal of Molecular Biology
, vol.234
, Issue.3
, pp. 779-815
-
-
Sali, A.1
Blundell, T.L.2
-
36
-
-
0037197857
-
Ab initio protein structure prediction on a genomic scale: Application to the Mycoplasma genitalium genome
-
DOI 10.1073/pnas.092135699
-
D. Kihara, Y. Zhang, H. Lu, A. Kolinski, and J. Skolnick Ab initio protein structure prediction to a genomic scale: application to the mycoplasma genitalium genome PNAS 99 2002 5993 5998 (Pubitemid 34493253)
-
(2002)
Proceedings of the National Academy of Sciences of the United States of America
, vol.99
, Issue.9
, pp. 5993-5998
-
-
Kihara, D.1
Zhang, Y.2
Lu, H.3
Kolinski, A.4
Skolnick, J.5
-
37
-
-
34249683488
-
Membrane protein structure: Prediction versus reality
-
A. Elofsson, and G. von Heijne Membrane protein structure: prediction versus reality Annu. Rev. Biochem. 76 2007 125 140
-
(2007)
Annu. Rev. Biochem.
, vol.76
, pp. 125-140
-
-
Elofsson, A.1
Von Heijne, G.2
-
38
-
-
50649125304
-
Structure and mechanics of membrane proteins
-
A. Engel, and H.E. Gaub Structure and mechanics of membrane proteins Annu. Rev. Biochem. 77 2008 127 148
-
(2008)
Annu. Rev. Biochem.
, vol.77
, pp. 127-148
-
-
Engel, A.1
Gaub, H.E.2
-
39
-
-
0037188377
-
Intrinsic disorder and protein function
-
DOI 10.1021/bi012159+
-
A.K. Dunker, C.J. Brown, J.D. Lawson, L.M. Iakoucheva, and Z. Obradovic Intrinsic disorder and protein function Biochemistry 41 2002 6573 6582 (Pubitemid 34547347)
-
(2002)
Biochemistry
, vol.41
, Issue.21
, pp. 6573-6582
-
-
Dunker, A.K.1
Brown, C.J.2
Lawson, J.D.3
Iakoucheva, L.M.4
Obradovic, Z.5
-
40
-
-
64549131279
-
ABSINTH: A new continuum solvation model for simulations of polypeptides in aqueous solutions
-
A. Vitalis, and R.V. Pappu ABSINTH: a new continuum solvation model for simulations of polypeptides in aqueous solutions J. Comput. Chem. 30 2009 673 699
-
(2009)
J. Comput. Chem.
, vol.30
, pp. 673-699
-
-
Vitalis, A.1
Pappu, R.V.2
-
41
-
-
77950618150
-
Molecular simulations of protein disorder
-
S. Rauscher, and R. Pomes Molecular simulations of protein disorder Biochem. Cell Biol. 88 2010 269 290
-
(2010)
Biochem. Cell Biol.
, vol.88
, pp. 269-290
-
-
Rauscher, S.1
Pomes, R.2
-
42
-
-
84857774493
-
Structure dynamics of an unfolded protein examined by molecular dynamics simulation
-
K. Lindorff-Larsen, N. Trbovic, P. Maragakis, S. Piana, and D.E. Shaw Structure dynamics of an unfolded protein examined by molecular dynamics simulation J. Am. Chem. Soc. 134 2012 3787 3791
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 3787-3791
-
-
Lindorff-Larsen, K.1
Trbovic, N.2
Maragakis, P.3
Piana, S.4
Shaw, D.E.5
-
43
-
-
27144448812
-
The bacterial nucleoid: A highly organized and dynamic structure
-
DOI 10.1002/jcb.20519
-
M. Thanbichler, S.C. Wang, and L. Shapiro The bacterial nucleoid: a highly organized and dynamic structure J. Cell. Biochem. 96 2005 506 521 (Pubitemid 41504649)
-
(2005)
Journal of Cellular Biochemistry
, vol.96
, Issue.3
, pp. 506-521
-
-
Thanbichler, M.1
Wang, S.C.2
Shapiro, L.3
-
44
-
-
0038497542
-
Molecular structure of nucleic acids: A structure for deoxyribose nucleic acid
-
J.D. Watson, and F.H. Crick Molecular structure of nucleic acids: a structure for deoxyribose nucleic acid Nature 171 1953 737
-
(1953)
Nature
, vol.171
, pp. 737
-
-
Watson, J.D.1
Crick, F.H.2
-
45
-
-
36949066642
-
Structure of haemoglobin - 3-dimensional Fourier synthesis at 5.5-A resolution obtained by X-ray analysis
-
M.F. Perutz, M.G. Rossmann, A.F. Cullis, H. Muirhead, G. Will, and A.C.T. North Structure of haemoglobin - 3-dimensional Fourier synthesis at 5.5-A resolution obtained by X-ray analysis Nature 185 1960 416 422
-
(1960)
Nature
, vol.185
, pp. 416-422
-
-
Perutz, M.F.1
Rossmann, M.G.2
Cullis, A.F.3
Muirhead, H.4
Will, G.5
North, A.C.T.6
-
46
-
-
0001266102
-
3-dimensional model of the myoglobin molecule obtained by X-ray analysis
-
J.C. Kendrew, G. Bodo, H.M. Dintzis, R.G. Parrish, H. Wyckoff, and D.C. Phillips 3-dimensional model of the myoglobin molecule obtained by X-ray analysis Nature 181 1958 662 666
-
(1958)
Nature
, vol.181
, pp. 662-666
-
-
Kendrew, J.C.1
Bodo, G.2
Dintzis, H.M.3
Parrish, R.G.4
Wyckoff, H.5
Phillips, D.C.6
-
48
-
-
33750531252
-
Chromosome organization and segregation in bacteria
-
DOI 10.1016/j.jsb.2006.05.007, PII S1047847706001869
-
M. Thanbichler, and L. Shapiro Chromosome organization and segregation in bacteria J. Struct. Biol. 156 2006 292 303 (Pubitemid 44666446)
-
(2006)
Journal of Structural Biology
, vol.156
, Issue.2
, pp. 292-303
-
-
Thanbichler, M.1
Shapiro, L.2
-
49
-
-
3142774839
-
Topological domain structure of the Escherichia coli chromosome
-
DOI 10.1101/gad.1207504
-
L. Postow, C.D. Hardy, J. Arsuaga, and N.R. Cozzarelli Topological domain structure of the Escherichia coli chromosome Genes Dev. 18 2004 1766 1779 (Pubitemid 38938191)
-
(2004)
Genes and Development
, vol.18
, Issue.14
, pp. 1766-1779
-
-
Postow, L.1
Hardy, C.D.2
Arsuaga, J.3
Cozzarelli, N.R.4
-
50
-
-
35648930403
-
Chromatin fiber structure: Where is the problem now?
-
DOI 10.1016/j.semcdb.2007.08.005, PII S1084952107001206, Membrane Lipid Microdomains: Roles in Signalling and Disease and 3D Chromatin
-
K. van Holde, and J. Zlatanova Chromatin fiber structure: where is the problem now? Semin. Cell Dev. Biol. 18 2007 651 658 (Pubitemid 350026429)
-
(2007)
Seminars in Cell and Developmental Biology
, vol.18
, Issue.5
, pp. 651-658
-
-
Van Holde, K.1
Zlatanova, J.2
-
51
-
-
84857033477
-
The two faces of Janus: Functional interactions and protein aggregation
-
A. Pastore, and P.A. Temussi The two faces of Janus: functional interactions and protein aggregation Curr. Opin. Struct. Biol. 22 2012 30 37
-
(2012)
Curr. Opin. Struct. Biol.
, vol.22
, pp. 30-37
-
-
Pastore, A.1
Temussi, P.A.2
-
52
-
-
0035827332
-
Structural basis of transcription: An RNA polymerase II elongation complex at 3.3 A resolution
-
DOI 10.1126/science.1059495
-
A.L. Gnatt, P. Cramer, J. Fu, D.A. Bushnell, and R.D. Kornberg Structural basis of transcription: an RNA polymerase II elongation complex at 3.3 a resolution Science 292 2001 1876 1882 (Pubitemid 32538357)
-
(2001)
Science
, vol.292
, Issue.5523
, pp. 1876-1882
-
-
Gnatt, A.L.1
Cramer, P.2
Fu, J.3
Bushnell, D.A.4
Kornberg, R.D.5
-
53
-
-
0034637111
-
The complete atomic structure of the large ribosomal subunit at 2.4 A resolution
-
DOI 10.1126/science.289.5481.905
-
N. Ban, P. Nissen, J. Hansen, P.B. Moore, and T.A. Steitz The complete atomic structure of the large ribosomal subunit at 2.4 angstrom resolution Science 289 2000 905 920 (Pubitemid 30659939)
-
(2000)
Science
, vol.289
, Issue.5481
, pp. 905-920
-
-
Ban, N.1
Nissen, P.2
Hansen, J.3
Moore, P.B.4
Steitz, T.A.5
-
54
-
-
1642355235
-
Flexible multi-scale fitting of atomic structures into low-resolution electron density maps with elastic network normal mode analysis
-
DOI 10.1016/j.jmb.2004.01.048, PII S0022283604001184
-
F. Tama, O. Miyashita, and C.L. Brooks Flexible multi-scale fitting of atomic structures into low-resolution electron density maps with elastic network normal mode analysis J. Mol. Biol. 337 2004 985 999 (Pubitemid 38368939)
-
(2004)
Journal of Molecular Biology
, vol.337
, Issue.4
, pp. 985-999
-
-
Tama, F.1
Miyashita, O.2
Brooks III, C.L.3
-
55
-
-
0036297629
-
Multi-resolution contour-based fitting of macromolecular structures
-
DOI 10.1006/jmbi.2002.5438
-
P. Chacon, and W. Wriggers Multi-resolution contour-based fitting of macromolecular structures J. Mol. Biol. 317 2002 375 384 (Pubitemid 34722177)
-
(2002)
Journal of Molecular Biology
, vol.317
, Issue.3
, pp. 375-384
-
-
Chacon, P.1
Wriggers, W.2
-
56
-
-
0035906702
-
Bridging the information gap: Computational tools for intermediate resolution structure interpretation
-
DOI 10.1006/jmbi.2001.4633
-
W. Jiang, M.L. Baker, S.J. Ludtke, and W. Chiu Bridging the information gap: computational tools for intermediate resolution structure interpretation J. Mol. Biol. 308 2001 1033 1044 (Pubitemid 32574375)
-
(2001)
Journal of Molecular Biology
, vol.308
, Issue.5
, pp. 1033-1044
-
-
Jiang, W.1
Baker, M.L.2
Ludtke, S.J.3
Chiu, W.4
-
57
-
-
77956992845
-
Bacterial TEM: New insights from cryo-microscopy
-
T. MullerReichert, Elsevier Academic Press Inc San Diego
-
M. Pilhofer, M.S. Ladinsky, A.W. McDowall, and G.J. Jensen Bacterial TEM: new insights from cryo-microscopy T. MullerReichert, Electron Microscopy of Model Systems 96 2010 Elsevier Academic Press Inc San Diego 21 45
-
(2010)
Electron Microscopy of Model Systems
, vol.96
, pp. 21-45
-
-
Pilhofer, M.1
Ladinsky, M.S.2
McDowall, A.W.3
Jensen, G.J.4
-
58
-
-
66349121016
-
Electron cryotomography: A new view into microbial ultrastructure
-
Z. Li, and G.J. Jensen Electron cryotomography: a new view into microbial ultrastructure Curr. Opin. Microbiol. 12 2009 333 340
-
(2009)
Curr. Opin. Microbiol.
, vol.12
, pp. 333-340
-
-
Li, Z.1
Jensen, G.J.2
-
59
-
-
70849132924
-
Proteome organization in a genome-reduced bacterium
-
S. Kuhner, V. van Noort, M.J. Betts, A. Leo-Macias, C. Batisse, and M. Rode Proteome organization in a genome-reduced bacterium Science 326 2009 1235 1240
-
(2009)
Science
, vol.326
, pp. 1235-1240
-
-
Kuhner, S.1
Van Noort, V.2
Betts, M.J.3
Leo-Macias, A.4
Batisse, C.5
Rode, M.6
-
60
-
-
77951681944
-
Functional motifs in biochemical reaction networks
-
J.J. Tyson, and B. Novak Functional motifs in biochemical reaction networks Annu. Rev. Phys. Chem. 61 2010 219 240
-
(2010)
Annu. Rev. Phys. Chem.
, vol.61
, pp. 219-240
-
-
Tyson, J.J.1
Novak, B.2
-
61
-
-
84864258618
-
A whole-cell computational model predicts phenotype from genotype
-
J.R. Karr, J.C. Sanghvi, D.N. Macklin, M.V. Gutschow, J.M. Jacobs, and B. Bolival A whole-cell computational model predicts phenotype from genotype Cell 150 2012 389 401
-
(2012)
Cell
, vol.150
, pp. 389-401
-
-
Karr, J.R.1
Sanghvi, J.C.2
Macklin, D.N.3
Gutschow, M.V.4
Jacobs, J.M.5
Bolival, B.6
-
62
-
-
84876554105
-
WholeCellKB: Model organism databases for comprehensive whole-cell models
-
D787-D92
-
J.R. Karr, J.C. Sanghvi, D.N. Macklin, A. Arora, and M.W. Covert WholeCellKB: model organism databases for comprehensive whole-cell models Nucleic Acids Res. 41 2013 D787-D92
-
(2013)
Nucleic Acids Res.
, vol.41
-
-
Karr, J.R.1
Sanghvi, J.C.2
Macklin, D.N.3
Arora, A.4
Covert, M.W.5
-
63
-
-
48249124302
-
Crowding effects on diffusion in solutions and cells
-
J.A. Dix, and A.S. Verkman Crowding effects on diffusion in solutions and cells Annu. Rev. Biophys. 37 2008 247 263
-
(2008)
Annu. Rev. Biophys.
, vol.37
, pp. 247-263
-
-
Dix, J.A.1
Verkman, A.S.2
-
64
-
-
84873643682
-
Stochastic models of intracellular transport
-
P.C. Bressloff, and J.M. Newby Stochastic models of intracellular transport Rev. Mod. Phys. 85 2013 135 196
-
(2013)
Rev. Mod. Phys.
, vol.85
, pp. 135-196
-
-
Bressloff, P.C.1
Newby, J.M.2
-
65
-
-
77951298407
-
Models of macromolecular crowding effects and the need for quantitative comparisons with experiment
-
A.H. Elcock Models of macromolecular crowding effects and the need for quantitative comparisons with experiment Curr. Opin. Struct. Biol. 20 2010 196 206
-
(2010)
Curr. Opin. Struct. Biol.
, vol.20
, pp. 196-206
-
-
Elcock, A.H.1
-
66
-
-
84877079511
-
Computer simulations of the bacterial cytoplasm
-
T. Frembgen-Kesner, and A.H. Elcock Computer simulations of the bacterial cytoplasm Biophys. Rev. 5 2013 109 119
-
(2013)
Biophys. Rev.
, vol.5
, pp. 109-119
-
-
Frembgen-Kesner, T.1
Elcock, A.H.2
-
67
-
-
84864720105
-
Smoothing of the GB1 hairpin folding landscape by interfacial confinement
-
A. Bhattacharya, R.B. Best, and J. Mittal Smoothing of the GB1 hairpin folding landscape by interfacial confinement Biophys. J. 103 2012 596 600
-
(2012)
Biophys. J.
, vol.103
, pp. 596-600
-
-
Bhattacharya, A.1
Best, R.B.2
Mittal, J.3
-
68
-
-
84876229882
-
Effects of confinement on the structure and dynamics of an intrinsically disordered peptide: A molecular dynamics study
-
J.S. Rao, and L.R. Cruz Effects of confinement on the structure and dynamics of an intrinsically disordered peptide: a molecular dynamics study J. Phys. Chem. B. 117 2013 3707 3719
-
(2013)
J. Phys. Chem. B.
, vol.117
, pp. 3707-3719
-
-
Rao, J.S.1
Cruz, L.R.2
-
69
-
-
80053060122
-
Simulation studies of protein folding/unfolding equilibrium under polar and nonpolar confinement
-
J.H. Tian, and A.E. Garcia Simulation studies of protein folding/unfolding equilibrium under polar and nonpolar confinement J. Am. Chem. Soc. 133 2011 15157 15164
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 15157-15164
-
-
Tian, J.H.1
Garcia, A.E.2
-
70
-
-
75649124901
-
Understanding how the crowded interior of cells stabilizes DNA/DNA and DNA/RNA hybrids-in silico predictions and in vitro evidence
-
K.S. Harve, R. Lareu, R. Rajagopalan, and M. Raghunath Understanding how the crowded interior of cells stabilizes DNA/DNA and DNA/RNA hybrids-in silico predictions and in vitro evidence Nucleic Acids Res. 38 2010 172 181
-
(2010)
Nucleic Acids Res.
, vol.38
, pp. 172-181
-
-
Harve, K.S.1
Lareu, R.2
Rajagopalan, R.3
Raghunath, M.4
-
71
-
-
84865356812
-
Ion-mediated RNA structural collapse: Effect of spatial confinement
-
Z.J. Tan, and S.J. Chen Ion-mediated RNA structural collapse: effect of spatial confinement Biophys. J. 103 2012 827 836
-
(2012)
Biophys. J.
, vol.103
, pp. 827-836
-
-
Tan, Z.J.1
Chen, S.J.2
-
72
-
-
79959394350
-
Simulations of the confinement of ubiquitin in self-assembled reverse micelles
-
J.H. Tian, and A.E. Garcia Simulations of the confinement of ubiquitin in self-assembled reverse micelles J. Chem. Phys. 134 2011 225101
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 225101
-
-
Tian, J.H.1
Garcia, A.E.2
-
73
-
-
84862563574
-
Crowding alters the folding kinetics of a beta-hairpin by modulating the stability of intermediates
-
N.A. Kurniawan, S. Enemark, and R. Rajagopalan Crowding alters the folding kinetics of a beta-hairpin by modulating the stability of intermediates J. Am. Chem. Soc. 134 2012 10200 10208
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 10200-10208
-
-
Kurniawan, N.A.1
Enemark, S.2
Rajagopalan, R.3
-
74
-
-
77149164191
-
Method to predict crowding effects by postprocessing molecular dynamics trajectories: Application to the flap dynamics of HIV-1 protease
-
S.B. Qin, D.D.L. Minh, J.A. McCammon, and H.X. Zhou Method to predict crowding effects by postprocessing molecular dynamics trajectories: application to the flap dynamics of HIV-1 protease J. Phys. Chem. Lett. 1 2010 107 110
-
(2010)
J. Phys. Chem. Lett.
, vol.1
, pp. 107-110
-
-
Qin, S.B.1
Minh, D.D.L.2
McCammon, J.A.3
Zhou, H.X.4
-
75
-
-
78049249046
-
Effects of macromolecular crowding on protein conformational changes
-
H. Dong, S.B. Qin, and H.X. Zhou Effects of macromolecular crowding on protein conformational changes PLoS Comput. Biol. 6 2010 e1000833
-
(2010)
PLoS Comput. Biol.
, vol.6
, pp. 1000833
-
-
Dong, H.1
Qin, S.B.2
Zhou, H.X.3
-
76
-
-
68949110044
-
Atomistic modeling of macromolecular crowding predicts modest increases in protein folding and binding stability
-
S.B. Qin, and H.X. Zhou Atomistic modeling of macromolecular crowding predicts modest increases in protein folding and binding stability Biophys. J. 97 2009 12 19
-
(2009)
Biophys. J.
, vol.97
, pp. 12-19
-
-
Qin, S.B.1
Zhou, H.X.2
-
77
-
-
77952775472
-
The folding transition-state ensemble of a four-helix bundle protein: Helix propensity as a determinant and macromolecular crowding as a probe
-
H. Tjong, and H.X. Zhou The folding transition-state ensemble of a four-helix bundle protein: helix propensity as a determinant and macromolecular crowding as a probe Biophys. J. 98 2010 2273 2280
-
(2010)
Biophys. J.
, vol.98
, pp. 2273-2280
-
-
Tjong, H.1
Zhou, H.X.2
-
78
-
-
78651449708
-
Crowding effects on protein association: Effect of interactions between crowding agents
-
J.S. Kim, and A. Yethiraj Crowding effects on protein association: effect of interactions between crowding agents J. Phys. Chem. B. 115 2011 347 353
-
(2011)
J. Phys. Chem. B.
, vol.115
, pp. 347-353
-
-
Kim, J.S.1
Yethiraj, A.2
-
81
-
-
51649087154
-
Effects of denaturants and osmolytes on proteins are accurately predicted by the molecular transfer model
-
E.P. O'Brien, G. Ziv, G. Haran, B.R. Brooks, and D. Thirumalai Effects of denaturants and osmolytes on proteins are accurately predicted by the molecular transfer model PNAS 105 2008 13403 13408
-
(2008)
PNAS
, vol.105
, pp. 13403-13408
-
-
O'Brien, E.P.1
Ziv, G.2
Haran, G.3
Brooks, B.R.4
Thirumalai, D.5
-
82
-
-
77951547846
-
Backbone additivity in the transfer model of protein solvation
-
C.Y. Hu, H. Kokubo, G.C. Lynch, D.W. Bolen, and B.M. Pettitt Backbone additivity in the transfer model of protein solvation Protein Sci. 19 2010 1011 1022
-
(2010)
Protein Sci.
, vol.19
, pp. 1011-1022
-
-
Hu, C.Y.1
Kokubo, H.2
Lynch, G.C.3
Bolen, D.W.4
Pettitt, B.M.5
-
83
-
-
77949878597
-
Trimethylamine-N-oxide influence on the backbone of proteins: An oligoglycine model
-
C.Y. Hu, G.C. Lynch, H. Kokubo, and B.M. Pettitt Trimethylamine-N-oxide influence on the backbone of proteins: an oligoglycine model Proteins 78 2010 695 704
-
(2010)
Proteins
, vol.78
, pp. 695-704
-
-
Hu, C.Y.1
Lynch, G.C.2
Kokubo, H.3
Pettitt, B.M.4
-
84
-
-
84868587589
-
Collapse of unfolded proteins in a mixture of denaturants
-
Z. Xia, P. Das, E.I. Shakhnovich, and R.H. Zhou Collapse of unfolded proteins in a mixture of denaturants J. Am. Chem. Soc. 134 2012 18266 18274
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 18266-18274
-
-
Xia, Z.1
Das, P.2
Shakhnovich, E.I.3
Zhou, R.H.4
-
85
-
-
63149153986
-
Urea's action on hydrophobic interactions
-
R. Zangi, R. Zhou, and B.J. Berne Urea's action on hydrophobic interactions J. Am. Chem. Soc. 131 2009 1535 1541
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 1535-1541
-
-
Zangi, R.1
Zhou, R.2
Berne, B.J.3
-
86
-
-
79960344032
-
Urea and guanidinium induced denaturation of a Trp-Cage miniprotein
-
J. Heyda, M. Kozisek, L. Bednarova, G. Thompson, J. Konvalinka, and J. Vondrasek Urea and guanidinium induced denaturation of a Trp-Cage miniprotein J. Phys. Chem. B. 115 2011 8910 8924
-
(2011)
J. Phys. Chem. B.
, vol.115
, pp. 8910-8924
-
-
Heyda, J.1
Kozisek, M.2
Bednarova, L.3
Thompson, G.4
Konvalinka, J.5
Vondrasek, J.6
-
87
-
-
62449341938
-
Urea, but not guanidinium, destabilizes proteins by forming hydrogen bonds to the peptide group
-
W.K. Lim, J. Rosgen, and S.W. Englander Urea, but not guanidinium, destabilizes proteins by forming hydrogen bonds to the peptide group PNAS 106 2009 2595 2600
-
(2009)
PNAS
, vol.106
, pp. 2595-2600
-
-
Lim, W.K.1
Rosgen, J.2
Englander, S.W.3
-
88
-
-
57049105810
-
Structural thermodynamics of protein preferential solvation: Osmolyte solvation of proteins, aminoacids, and peptides
-
M. Auton, D.W. Bolen, and J. Rosgen Structural thermodynamics of protein preferential solvation: osmolyte solvation of proteins, aminoacids, and peptides Proteins 73 2008 802 813
-
(2008)
Proteins
, vol.73
, pp. 802-813
-
-
Auton, M.1
Bolen, D.W.2
Rosgen, J.3
-
89
-
-
39149104991
-
Recent applications of Kirkwood-Buff theory to biological systems
-
V. Pierce, M. Kang, M. Aburi, S. Weerasinghe, and P.E. Smith Recent applications of Kirkwood-Buff theory to biological systems Cell Biochem. Biophys. 50 2008 1 22
-
(2008)
Cell Biochem. Biophys.
, vol.50
, pp. 1-22
-
-
Pierce, V.1
Kang, M.2
Aburi, M.3
Weerasinghe, S.4
Smith, P.E.5
-
90
-
-
55949131241
-
Urea denaturation by stronger dispersion interactions with proteins than water implies a 2-stage unfolding
-
L. Hua, R. Zhou, D. Thirumalai, and B.J. Berne Urea denaturation by stronger dispersion interactions with proteins than water implies a 2-stage unfolding PNAS 105 2008 16928 16933
-
(2008)
PNAS
, vol.105
, pp. 16928-16933
-
-
Hua, L.1
Zhou, R.2
Thirumalai, D.3
Berne, B.J.4
-
91
-
-
34249806047
-
Preferential solvation in urea solutions at different concentrations: Properties from simulation studies
-
DOI 10.1021/jp067659x
-
H. Kokubo, and B.M. Pettitt Preferential solvation in urea solutions at different concentrations: properties from simulation studies J. Phys. Chem. B. 111 2007 5233 5242 (Pubitemid 46854511)
-
(2007)
Journal of Physical Chemistry B
, vol.111
, Issue.19
, pp. 5233-5242
-
-
Kokubo, H.1
Pettitt, B.M.2
-
92
-
-
33646163934
-
Does urea denature hydrophobic interactions?
-
M.E. Lee, and N.F.A. van der Vegt Does urea denature hydrophobic interactions? J. Am. Chem. Soc. 128 2006 4948 4949
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 4948-4949
-
-
Lee, M.E.1
Van Der Vegt, N.F.A.2
-
93
-
-
33745357168
-
Direct observation of salt effects on molecular interactions through explicit-solvent molecular dynamics simulations: Differential effects on electrostatic and hydrophobic interactions and comparisons to Poisson-Boltzmann theory
-
DOI 10.1021/ja058637b
-
A.S. Thomas, and A.H. Elcock Direct observation of salt effects on molecular interactions through explicit-solvent molecular dynamics simulations: differential effects on electrostatic and hydrophobic interactions and comparisons to Poisson-Boltzmann theory J. Am. Chem. Soc. 128 2006 7796 7806 (Pubitemid 43945722)
-
(2006)
Journal of the American Chemical Society
, vol.128
, Issue.24
, pp. 7796-7806
-
-
Thomas, A.S.1
Elcock, A.H.2
-
94
-
-
78651256762
-
Direct measurement of the kinetics and thermodynamics of association of hydrophobic molecules from molecular dynamics simulations
-
A.S. Thomas, and A.H. Elcock Direct measurement of the kinetics and thermodynamics of association of hydrophobic molecules from molecular dynamics simulations J. Phys. Chem. Lett. 2 2011 19 24
-
(2011)
J. Phys. Chem. Lett.
, vol.2
, pp. 19-24
-
-
Thomas, A.S.1
Elcock, A.H.2
-
95
-
-
68949108322
-
Sequence and crowding effects in the aggregation of a 10-residue fragment derived from islet amyloid polypeptide
-
E. Rivera, J. Straub, and D. Thirumalai Sequence and crowding effects in the aggregation of a 10-residue fragment derived from islet amyloid polypeptide Biophys. J. 96 2009 4552 4560
-
(2009)
Biophys. J.
, vol.96
, pp. 4552-4560
-
-
Rivera, E.1
Straub, J.2
Thirumalai, D.3
-
96
-
-
84858198890
-
Protein crowding affects hydration structure and dynamics
-
R. Harada, Y. Sugita, and M. Feig Protein crowding affects hydration structure and dynamics J. Am. Chem. Soc. 134 2012 4842 4849
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 4842-4849
-
-
Harada, R.1
Sugita, Y.2
Feig, M.3
-
98
-
-
61949243261
-
High-resolution multi-dimensional NMR spectroscopy of proteins in human cells
-
K. Inomata, A. Ohno, H. Tochio, S. Isogai, T. Tenno, and I. Nakase High-resolution multi-dimensional NMR spectroscopy of proteins in human cells Nature 458 2009 106 109
-
(2009)
Nature
, vol.458
, pp. 106-109
-
-
Inomata, K.1
Ohno, A.2
Tochio, H.3
Isogai, S.4
Tenno, T.5
Nakase, I.6
-
99
-
-
33749054520
-
Molecular crowding effects on protein stability
-
F. Despa, D.P. Orgill, and R.C. Lee Molecular crowding effects on protein stability Ann. N.Y. Acad. Sci. 1066 2005 54 66
-
(2005)
Ann. N.Y. Acad. Sci.
, vol.1066
, pp. 54-66
-
-
Despa, F.1
Orgill, D.P.2
Lee, R.C.3
-
100
-
-
44349088135
-
Residue-level interrogation of macromolecular crowding effects on protein stability
-
DOI 10.1021/ja8005995
-
L.M. Charlton, C.O. Barnes, C. Li, J. Orans, G.B. Young, and G.J. Pielak Residue-level interrogation of macromolecular crowding effects on protein stability J. Am. Chem. Soc. 130 2008 6826 6830 (Pubitemid 351748420)
-
(2008)
Journal of the American Chemical Society
, vol.130
, Issue.21
, pp. 6826-6830
-
-
Charlton, L.M.1
Barnes, C.O.2
Li, C.3
Orans, J.4
Young, G.B.5
Pielak, G.J.6
-
101
-
-
77955686807
-
Effects of proteins on protein diffusion
-
Y. Wang, C. Li, and G.J. Pielak Effects of proteins on protein diffusion J. Am. Chem. Soc. 132 2010 9392 9397
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 9392-9397
-
-
Wang, Y.1
Li, C.2
Pielak, G.J.3
-
102
-
-
84866918051
-
Mixing normal and anomalous diffusion
-
T. Geyer Mixing normal and anomalous diffusion J. Chem. Phys. 137 2012 115101
-
(2012)
J. Chem. Phys.
, vol.137
, pp. 115101
-
-
Geyer, T.1
-
103
-
-
84863769908
-
Anomalous diffusion and multifractional Brownian motion: Simulating molecular crowding and physical obstacles in systems biology
-
T.T. Marquez-Lago, A. Leier, and K. Burrage Anomalous diffusion and multifractional Brownian motion: simulating molecular crowding and physical obstacles in systems biology IET Syst. Biol. 6 2012 134 142
-
(2012)
IET Syst. Biol.
, vol.6
, pp. 134-142
-
-
Marquez-Lago, T.T.1
Leier, A.2
Burrage, K.3
-
104
-
-
0028140412
-
Anomalous diffusion due to obstacles: A Monte Carlo study
-
M.J. Saxton Anomalous diffusion due to obstacles: a Monte Carlo study Biophys. J. 66 1994 394 401 (Pubitemid 24058459)
-
(1994)
Biophysical Journal
, vol.66
, Issue.2
, pp. 394-401
-
-
Saxton, M.J.1
-
105
-
-
33748273567
-
Extending the horizon: Towards the efficient modeling of large biomolecular complexes in atomic detail
-
DOI 10.1007/s00214-005-0062-4
-
M. Feig, J. Chocholousova, and S. Tanizaki Extending the horizon: towards the efficient modeling of large biomolecular complexes in atomic detail Theor. Chem. Acc. 116 2006 194 205 (Pubitemid 44318424)
-
(2006)
Theoretical Chemistry Accounts
, vol.116
, Issue.1-3
, pp. 194-205
-
-
Feig, M.1
Chocholousova, J.2
Tanizaki, S.3
-
106
-
-
38849196324
-
Water as an active constituent in cell biology
-
DOI 10.1021/cr068037a
-
P. Ball Water as an active constituent in cell biology Chem. Rev. 108 2008 74 108 (Pubitemid 351187472)
-
(2008)
Chemical Reviews
, vol.108
, Issue.1
, pp. 74-108
-
-
Ball, P.1
-
107
-
-
84988087911
-
Calculating the electrostatic potential of molecules in solution: Method and error assessment
-
M.K. Gilson, K.A. Sharp, and B.H. Honig Calculating the electrostatic potential of molecules in solution: method and error assessment J. Comput. Chem. 9 1987 327 335
-
(1987)
J. Comput. Chem.
, vol.9
, pp. 327-335
-
-
Gilson, M.K.1
Sharp, K.A.2
Honig, B.H.3
-
109
-
-
55549083180
-
Prediction of protein solubility from calculation of transfer free energy
-
H. Tjong, and H.X. Zhou Prediction of protein solubility from calculation of transfer free energy Biophys. J. 95 2008 2601 2609
-
(2008)
Biophys. J.
, vol.95
, pp. 2601-2609
-
-
Tjong, H.1
Zhou, H.X.2
-
110
-
-
84986486656
-
A rapid finite-difference algorithm, utilizing successive over-relaxation to solve the Poisson-Boltzmann equation
-
A. Nicholls, and B. Honig A rapid finite-difference algorithm, utilizing successive over-relaxation to solve the Poisson-Boltzmann equation J. Comput. Chem. 12 1991 435 445
-
(1991)
J. Comput. Chem.
, vol.12
, pp. 435-445
-
-
Nicholls, A.1
Honig, B.2
-
111
-
-
1942456697
-
Recent advances in the development and application of implicit solvent models in biomolecule simulations
-
DOI 10.1016/j.sbi.2004.03.009, PII S0959440X04000430
-
M. Feig, and C.L. Brooks III Recent advances in the development and application of implicit solvent models in biomolecule simulations Curr. Opin. Struct. Biol. 14 2004 217 224 (Pubitemid 38495800)
-
(2004)
Current Opinion in Structural Biology
, vol.14
, Issue.2
, pp. 217-224
-
-
Feig, M.1
Brooks III, C.L.2
-
112
-
-
32844457567
-
Accurate calculation of hydration free-energies using macroscopic solvent models
-
D. Sitkoff, K.A. Sharp, and B. Honig Accurate calculation of hydration free-energies using macroscopic solvent models J. Phys. Chem. 98 1994 1978 1988
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 1978-1988
-
-
Sitkoff, D.1
Sharp, K.A.2
Honig, B.3
-
114
-
-
0042208326
-
On the nonpolar hydration free energy of proteins: Surface area and continuum solvent models for the solute-solvent interaction energy
-
DOI 10.1021/ja029833a
-
R.M. Levy, L.Y. Zhang, E. Gallicchio, and A.K. Felts On the nonpolar hydration free energy of proteins: surface area and continuum solvent models for the solute-solvent interaction energy J. Am. Chem. Soc. 125 2003 9523 9530 (Pubitemid 36936069)
-
(2003)
Journal of the American Chemical Society
, vol.125
, Issue.31
, pp. 9523-9530
-
-
Levy, R.M.1
Zhang, L.Y.2
Gallicchio, E.3
Felts, A.K.4
-
115
-
-
17444426051
-
A generalized Born formalism for heterogeneous dielectric environments: Application to the implicit modeling of biological membranes
-
S. Tanizaki, and M. Feig A generalized Born formalism for heterogeneous dielectric environments: application to the implicit modeling of biological membranes J. Chem. Phys. 122 2005 124706
-
(2005)
J. Chem. Phys.
, vol.122
, pp. 124706
-
-
Tanizaki, S.1
Feig, M.2
-
116
-
-
0242322528
-
An Implicit Membrane Generalized Born Theory for the Study of Structure, Stability, and Interactions of Membrane Proteins
-
W. Im, M. Feig, and C.L. Brooks III An implicit membrane generalized Born theory for the study of structure stability, and interactions of membrane proteins Biophys. J. 85 2003 2900 2918 (Pubitemid 37345782)
-
(2003)
Biophysical Journal
, vol.85
, Issue.5
, pp. 2900-2918
-
-
Im, W.1
Feig, M.2
Brooks III, C.L.3
-
117
-
-
0038675609
-
Effective energy function for proteins in lipid membranes
-
DOI 10.1002/prot.10410
-
T. Lazaridis Effective energy function for proteins in lipid membranes Proteins 52 2003 176 192 (Pubitemid 36828942)
-
(2003)
Proteins: Structure, Function and Genetics
, vol.52
, Issue.2
, pp. 176-192
-
-
Lazaridis, T.1
-
118
-
-
38549152231
-
Conformational sampling of peptides in cellular environments
-
DOI 10.1529/biophysj.107.116236
-
S. Tanizaki, J.W. Clifford, B.D. Connelly, and M. Feig Conformational sampling of peptides in cellular environments Biophys. J. 94 2008 747 759 (Pubitemid 351162445)
-
(2008)
Biophysical Journal
, vol.94
, Issue.3
, pp. 747-759
-
-
Tanizaki, S.1
Clifford, J.2
Connelly, B.D.3
Feig, M.4
-
119
-
-
84864254504
-
Conformational sampling of peptides in the presence of protein crowders from AA/CG-multiscale simulations
-
A.V. Predeus, S. Gul, S.M. Gopal, and M. Feig Conformational sampling of peptides in the presence of protein crowders from AA/CG-multiscale simulations J. Phys. Chem. B. 116 2012 8610 8620
-
(2012)
J. Phys. Chem. B.
, vol.116
, pp. 8610-8620
-
-
Predeus, A.V.1
Gul, S.2
Gopal, S.M.3
Feig, M.4
-
120
-
-
0022816745
-
The dielectric-constant of a folded protein
-
M.K. Gilson, and B.H. Honig The dielectric-constant of a folded protein Biopolymers 25 1986 2097 2119
-
(1986)
Biopolymers
, vol.25
, pp. 2097-2119
-
-
Gilson, M.K.1
Honig, B.H.2
-
122
-
-
0033468737
-
Application of a pairwise generalized Born model to proteins and nucleic acids: Inclusion of salt effects
-
J. Srinivasan, M.W. Trevathan, P. Beroza, and D.A. Case Application of a pairwise generalized Born model to proteins and nucleic acids: inclusion of salt effects Theor. Chim. Acta 101 1999 426 434
-
(1999)
Theor. Chim. Acta
, vol.101
, pp. 426-434
-
-
Srinivasan, J.1
Trevathan, M.W.2
Beroza, P.3
Case, D.A.4
-
123
-
-
70349881890
-
Association and electrostatic steering of alpha-lactalbumin-lysozyme heterodimers
-
B.A. Persson, and M. Lund Association and electrostatic steering of alpha-lactalbumin-lysozyme heterodimers Phys. Chem. Chem. Phys. 11 2009 8879 8885
-
(2009)
Phys. Chem. Chem. Phys.
, vol.11
, pp. 8879-8885
-
-
Persson, B.A.1
Lund, M.2
-
124
-
-
33645408056
-
Balancing solvation and intramolecular interactions: Toward a consistent generalized born force field
-
J.H. Chen, W.P. Im, and C.L. Brooks Balancing solvation and intramolecular interactions: toward a consistent generalized born force field J. Am. Chem. Soc. 128 2006 3728 3736
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 3728-3736
-
-
Chen, J.H.1
Im, W.P.2
Brooks, C.L.3
-
125
-
-
0000274247
-
Molecular theory of Brownian motion for several particles
-
J.M. Deutch, and I. Oppenhei Molecular theory of Brownian motion for several particles J. Chem. Phys. 54 1971 3547
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 3547
-
-
Deutch, J.M.1
Oppenhei, I.2
-
126
-
-
35948997379
-
Kinetics from implicit solvent simulations of biomolecules as a function of viscosity
-
M. Feig Kinetics from implicit solvent simulations of biomolecules as a function of viscosity J. Chem. Theory Comput. 3 2007 1734 1748
-
(2007)
J. Chem. Theory Comput.
, vol.3
, pp. 1734-1748
-
-
Feig, M.1
-
127
-
-
0042561888
-
Solvent viscosity dependence of the folding rate of a small protein: Distributed computing study
-
B. Zagrovic, and V. Pande Solvent viscosity dependence of the folding rate of a small protein: distributed computing study J. Comput. Chem. 24 2003 1432 1436
-
(2003)
J. Comput. Chem.
, vol.24
, pp. 1432-1436
-
-
Zagrovic, B.1
Pande, V.2
-
128
-
-
80052887328
-
Diffusion in crowded biological environments: Applications of Brownian dynamics
-
M. Dlugosz, and J. Trylska Diffusion in crowded biological environments: applications of Brownian dynamics BMC Biophys. 2011 4
-
(2011)
BMC Biophys.
, pp. 4
-
-
Dlugosz, M.1
Trylska, J.2
-
129
-
-
33750652614
-
Brownian dynamics with hydrodynamic interactions
-
D.L. Ermak, and J.A. Mccammon Brownian dynamics with hydrodynamic interactions J. Chem. Phys. 69 1978 1352 1360
-
(1978)
J. Chem. Phys.
, vol.69
, pp. 1352-1360
-
-
Ermak, D.L.1
McCammon, J.A.2
-
130
-
-
33748804712
-
Atomically detailed simulations of concentrated protein solutions: The effects of salt, pH, point mutations, and protein concentration in simulations of 1000-molecule systems
-
DOI 10.1021/ja0614058
-
S.R. McGuffee, and A.H. Elcock Atomically detailed simulations of concentrated protein solutions: the effects of salt, pH, point mutations, and protein concentration in simulations of 1000-molecule systems J. Am. Chem. Soc. 128 2006 12098 12110 (Pubitemid 44413841)
-
(2006)
Journal of the American Chemical Society
, vol.128
, Issue.37
, pp. 12098-12110
-
-
McGuffee, S.R.1
Elcock, A.H.2
-
131
-
-
78649859456
-
Brownian dynamics simulation of protein solutions structural and dynamical properties
-
P. Mereghetti, R.R. Gabdoulline, and R.C. Wade Brownian dynamics simulation of protein solutions structural and dynamical properties Biophys. J. 99 2010 3782 3791
-
(2010)
Biophys. J.
, vol.99
, pp. 3782-3791
-
-
Mereghetti, P.1
Gabdoulline, R.R.2
Wade, R.C.3
-
132
-
-
84864225957
-
Atomic detail Brownian dynamics simulations of concentrated protein solutions with a mean field treatment of hydrodynamic interactions
-
P. Mereghetti, and R.C. Wade Atomic detail Brownian dynamics simulations of concentrated protein solutions with a mean field treatment of hydrodynamic interactions J. Phys. Chem. B. 116 2012 8523 8533
-
(2012)
J. Phys. Chem. B.
, vol.116
, pp. 8523-8533
-
-
Mereghetti, P.1
Wade, R.C.2
-
133
-
-
84933517499
-
Variational treatment of hydrodynamic interaction in polymers
-
J. Rotne, and S. Prager Variational treatment of hydrodynamic interaction in polymers J. Chem. Phys. 50 1969 4831
-
(1969)
J. Chem. Phys.
, vol.50
, pp. 4831
-
-
Rotne, J.1
Prager, S.2
-
134
-
-
36849101815
-
Transport properties of polymer chains in dilute solution - Hydrodynamic interaction
-
H. Yamakawa Transport properties of polymer chains in dilute solution - hydrodynamic interaction J. Chem. Phys. 53 1970 436
-
(1970)
J. Chem. Phys.
, vol.53
, pp. 436
-
-
Yamakawa, H.1
-
136
-
-
0023525420
-
Dynamic simulation of hydrodynamically interacting particles
-
L. Durlofsky, J.F. Brady, and G. Bossis Dynamic simulation of hydrodynamically interacting particles J. Fluid Mech. 180 1987 21 49 (Pubitemid 17639867)
-
(1987)
Journal of Fluid Mechanics
, vol.180
, pp. 21-49
-
-
Durlofsky, L.1
Brady, J.F.2
Bossis, G.3
-
137
-
-
78349288528
-
Absolute protein-protein association rate constants from flexible coarse-grained Brownian dynamics simulations: The role of intermolecular hydrodynamic interactions in Barnase-Barstar association
-
T. Frembgen-Kesner, and A.H. Elcock Absolute protein-protein association rate constants from flexible coarse-grained Brownian dynamics simulations: the role of intermolecular hydrodynamic interactions in Barnase-Barstar association Biophys. J. 99 2010 L75 L77
-
(2010)
Biophys. J.
, vol.99
-
-
Frembgen-Kesner, T.1
Elcock, A.H.2
-
138
-
-
65249094240
-
Striking effects of hydrodynamic interactions on the simulated diffusion and folding of proteins
-
T. Frembgen-Kesner, and A.H. Elcock Striking effects of hydrodynamic interactions on the simulated diffusion and folding of proteins J. Chem. Theory Comput. 5 2009 242 256
-
(2009)
J. Chem. Theory Comput.
, vol.5
, pp. 242-256
-
-
Frembgen-Kesner, T.1
Elcock, A.H.2
-
139
-
-
84872157279
-
On the importance of hydrodynamic interactions in lipid membrane formation
-
T. Ando, and J. Skolnick On the importance of hydrodynamic interactions in lipid membrane formation Biophys. J. 104 2013 96 105
-
(2013)
Biophys. J.
, vol.104
, pp. 96-105
-
-
Ando, T.1
Skolnick, J.2
-
140
-
-
84865177208
-
Krylov subspace methods for computing hydrodynamic interactions in Brownian dynamics simulations
-
T. Ando, E. Chow, Y. Saad, and J. Skolnick Krylov subspace methods for computing hydrodynamic interactions in Brownian dynamics simulations J. Chem. Phys. 137 2012 064106
-
(2012)
J. Chem. Phys.
, vol.137
, pp. 064106
-
-
Ando, T.1
Chow, E.2
Saad, Y.3
Skolnick, J.4
-
141
-
-
84870187166
-
Aqueous phase separation as a possible route to compartmentalization of biological molecules
-
C.D. Keating Aqueous phase separation as a possible route to compartmentalization of biological molecules Acc. Chem. Res. 45 2012 2114 2124
-
(2012)
Acc. Chem. Res.
, vol.45
, pp. 2114-2124
-
-
Keating, C.D.1
-
142
-
-
79851514947
-
Exploring the spatial and temporal organization of a cell's proteome
-
M. Beck, M. Topf, Z. Frazier, H. Tjong, M. Xu, and S.H. Zhang Exploring the spatial and temporal organization of a cell's proteome J. Struct. Biol. 173 2011 483 496
-
(2011)
J. Struct. Biol.
, vol.173
, pp. 483-496
-
-
Beck, M.1
Topf, M.2
Frazier, Z.3
Tjong, H.4
Xu, M.5
Zhang, S.H.6
-
143
-
-
84862776582
-
Phase transitions in the assembly of multivalent signalling proteins
-
P.L. Li, S. Banjade, H.C. Cheng, S. Kim, B. Chen, and L. Guo Phase transitions in the assembly of multivalent signalling proteins Nature 483 2012 336 340
-
(2012)
Nature
, vol.483
, pp. 336-340
-
-
Li, P.L.1
Banjade, S.2
Cheng, H.C.3
Kim, S.4
Chen, B.5
Guo, L.6
-
144
-
-
0034919604
-
Channeling of substrates and intermediates in enzyme-catalyzed reactions
-
DOI 10.1146/annurev.biochem.70.1.149
-
X. Huang, H.M. Holden, and F.M. Raushel Channeling of substrates and intermediates in enzyme-catalyzed reactions Annu. Rev. Biochem. 70 2001 149 180 (Pubitemid 32662208)
-
(2001)
Annual Review of Biochemistry
, vol.70
, pp. 149-180
-
-
Huang, X.1
Holden, H.M.2
Raushel, F.M.3
-
145
-
-
49649111573
-
Protein-based organelles in bacteria: Carboxysomes and related microcompartments
-
T.O. Yeates, C.A. Kerfeld, S. Heinhorst, G.C. Cannon, and J.M. Shively Protein-based organelles in bacteria: carboxysomes and related microcompartments Nat. Rev. Microbiol. 6 2008 681 691
-
(2008)
Nat. Rev. Microbiol.
, vol.6
, pp. 681-691
-
-
Yeates, T.O.1
Kerfeld, C.A.2
Heinhorst, S.3
Cannon, G.C.4
Shively, J.M.5
-
146
-
-
63149129721
-
An O(N-2) approximation for hydrodynamic interactions in Brownian dynamics simulations
-
T. Geyer, and U. Winter An O(N-2) approximation for hydrodynamic interactions in Brownian dynamics simulations J. Chem. Phys. 130 2009 114905
-
(2009)
J. Chem. Phys.
, vol.130
, pp. 114905
-
-
Geyer, T.1
Winter, U.2
-
147
-
-
77951212412
-
PRIMO/PRIMONA: A coarse-grained model for proteins and nucleic acids that preserves near-atomistic accuracy
-
S.M. Gopal, S. Mukherjee, Y.-M. Cheng, and M. Feig PRIMO/PRIMONA: a coarse-grained model for proteins and nucleic acids that preserves near-atomistic accuracy Proteins 78 2010 1266 1281
-
(2010)
Proteins
, vol.78
, pp. 1266-1281
-
-
Gopal, S.M.1
Mukherjee, S.2
Cheng, Y.-M.3
Feig, M.4
-
148
-
-
0000095892
-
A united-residue force field for off-lattice protein-structure simulations. I. Functional forms and parameters of long-range side-chain interaction potentials from protein crystal data
-
A. Liwo, S. Oldziej, M.R. Pincus, R.J. Wawak, S. Rackovsky, and H.A. Scheraga A united-residue force field for off-lattice protein-structure simulations I. Functional forms and parameters of long-range side-chain interaction potentials from protein crystal data J. Comput. Chem. 18 1997 849 873 (Pubitemid 127598574)
-
(1997)
Journal of Computational Chemistry
, vol.18
, Issue.7
, pp. 849-873
-
-
Liwo, A.1
Oldziej, S.2
Pincus, M.R.3
Wawak, R.J.4
Rackovsky, S.5
Scheraga, H.A.6
-
149
-
-
0000095890
-
A united-residue force field for off-lattice protein-structure simulations. II. Parameterization of short-range interactions and determination of weights of energy terms by Z-score optimization
-
A. Liwo, M.R. Pincus, R.J. Wawak, S. Rackovsky, S. Oldziej, and H.A. Scheraga A united-residue force field for off-lattice protein-structure simulations II. Parameterization of short-range interactions and determination of weights of energy terms by Z-score optimization J. Comput. Chem. 18 1997 874 887 (Pubitemid 127598575)
-
(1997)
Journal of Computational Chemistry
, vol.18
, Issue.7
, pp. 874-887
-
-
Liwo, A.1
Pincus, M.R.2
Wawak, R.J.3
Rackovsky, S.4
Oldziej, S.5
Scheraga, H.A.6
-
150
-
-
84878582888
-
Spatial simulations in systems biology: From molecules to cells
-
M. Klann, and H. Koeppl Spatial simulations in systems biology: from molecules to cells Int. J. Mol. Sci. 13 2012 7798 7827
-
(2012)
Int. J. Mol. Sci.
, vol.13
, pp. 7798-7827
-
-
Klann, M.1
Koeppl, H.2
-
151
-
-
84864206909
-
Influence of the shape of crowding particles on the structural transitions in a polymer
-
A. Kudlay, M.S. Cheung, and D. Thirumalai Influence of the shape of crowding particles on the structural transitions in a polymer J. Phys. Chem. B. 116 2012 8513 8522
-
(2012)
J. Phys. Chem. B.
, vol.116
, pp. 8513-8522
-
-
Kudlay, A.1
Cheung, M.S.2
Thirumalai, D.3
-
152
-
-
61749097701
-
Crowding effects on the mechanical stability and unfolding pathways of ubiquitin
-
D.L. Pincus, and D. Thirumalai Crowding effects on the mechanical stability and unfolding pathways of ubiquitin J. Phys. Chem. B. 113 2009 359 368
-
(2009)
J. Phys. Chem. B.
, vol.113
, pp. 359-368
-
-
Pincus, D.L.1
Thirumalai, D.2
-
153
-
-
54849440101
-
Effects of confinement and crowding on folding of model proteins
-
M. Wojciehowski, and M. Cieplak Effects of confinement and crowding on folding of model proteins Biosystems 94 2008 248 252
-
(2008)
Biosystems
, vol.94
, pp. 248-252
-
-
Wojciehowski, M.1
Cieplak, M.2
-
154
-
-
65249154187
-
Confinement effects on the kinetics and thermodynamics of protein dimerization
-
W. Wang, W.X. Xu, Y. Levy, E. Trizac, and P.G. Wolynes Confinement effects on the kinetics and thermodynamics of protein dimerization PNAS 106 2009 5517 5522
-
(2009)
PNAS
, vol.106
, pp. 5517-5522
-
-
Wang, W.1
Xu, W.X.2
Levy, Y.3
Trizac, E.4
Wolynes, P.G.5
-
155
-
-
79952745066
-
Modest protein-crowder attractive interactions can counteract enhancement of protein association by intermolecular excluded volume interactions
-
J. Rosen, Y.C. Kim, and J. Mittal Modest protein-crowder attractive interactions can counteract enhancement of protein association by intermolecular excluded volume interactions J. Phys. Chem. B. 115 2011 2683 2689
-
(2011)
J. Phys. Chem. B.
, vol.115
, pp. 2683-2689
-
-
Rosen, J.1
Kim, Y.C.2
Mittal, J.3
-
156
-
-
78650080825
-
Macromolecular crowding effects on protein-protein binding affinity and specificity
-
Y.C. Kim, R.B. Best, and J. Mittal Macromolecular crowding effects on protein-protein binding affinity and specificity J. Chem. Phys. 133 2010 205101
-
(2010)
J. Chem. Phys.
, vol.133
, pp. 205101
-
-
Kim, Y.C.1
Best, R.B.2
Mittal, J.3
-
157
-
-
34547362785
-
Effects of frustration, confinement, and surface interactions on the dimerization of an off-lattice beta-barrel protein
-
M.A. Griffin, M. Friedel, and J.E. Shea Effects of frustration, confinement, and surface interactions on the dimerization of an off-lattice beta-barrel protein J. Chem. Phys. 123 2005 174707
-
(2005)
J. Chem. Phys.
, vol.123
, pp. 174707
-
-
Griffin, M.A.1
Friedel, M.2
Shea, J.E.3
-
158
-
-
21644448769
-
Effects of confinement on the thermodynamics of a collapsing heteropolymer: An off-lattice Wang-Landau Monte Carlo simulation study
-
DOI 10.1021/ma050443t
-
Y. Sliozberg, and C.F. Abrams Effects of confinement on the thermodynamics of a collapsing heteropolymer: an off-lattice Wang-Landau Monte Carlo simulation study Macromolecules 38 2005 5321 5329 (Pubitemid 40925694)
-
(2005)
Macromolecules
, vol.38
, Issue.12
, pp. 5321-5329
-
-
Sliozberg, Y.1
Abrams, C.F.2
-
159
-
-
84858665589
-
Anisotropic interactions in protein mixtures: Self assembly and phase behavior in aqueous solution
-
A. Kurut, B.A. Persson, T. Akesson, J. Forsman, and M. Lund Anisotropic interactions in protein mixtures: self assembly and phase behavior in aqueous solution J. Phys. Chem. Lett. 3 2012 731 734
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 731-734
-
-
Kurut, A.1
Persson, B.A.2
Akesson, T.3
Forsman, J.4
Lund, M.5
-
160
-
-
78751481478
-
The influence of hydrodynamic interactions on protein dynamics in confined and crowded spaces-assessment in simple models
-
M. Wojciechowski, P. Szymczak, and M. Cieplak The influence of hydrodynamic interactions on protein dynamics in confined and crowded spaces-assessment in simple models Phys. Biol. 7 2010 046011
-
(2010)
Phys. Biol.
, vol.7
, pp. 046011
-
-
Wojciechowski, M.1
Szymczak, P.2
Cieplak, M.3
-
161
-
-
69149106332
-
Force induced unfolding of biopolymers in a cellular environment: A model study
-
A.R. Singh, D. Giri, and S. Kumar Force induced unfolding of biopolymers in a cellular environment: a model study J. Chem. Phys. 2009 131
-
(2009)
J. Chem. Phys.
, pp. 131
-
-
Singh, A.R.1
Giri, D.2
Kumar, S.3
-
162
-
-
66749105078
-
Effects of molecular crowding on stretching of polymers in poor solvent
-
A.R. Singh, D. Giri, and S. Kumar Effects of molecular crowding on stretching of polymers in poor solvent Phys. Rev. E. 79 2009 051801
-
(2009)
Phys. Rev. E.
, vol.79
, pp. 051801
-
-
Singh, A.R.1
Giri, D.2
Kumar, S.3
-
163
-
-
66749141761
-
A Monte Carlo study of crowding effects on the self-assembly of amphiphilic molecules
-
F.X. Zheng, G.J. Chen, X.R. Zhang, and W.C. Wang A Monte Carlo study of crowding effects on the self-assembly of amphiphilic molecules J. Chem. Phys. 130 2009 204701
-
(2009)
J. Chem. Phys.
, vol.130
, pp. 204701
-
-
Zheng, F.X.1
Chen, G.J.2
Zhang, X.R.3
Wang, W.C.4
-
164
-
-
77950239567
-
Macromolecular crowding induces polypeptide compaction and decreases folding cooperativity
-
D. Tsao, and N.V. Dokholyan Macromolecular crowding induces polypeptide compaction and decreases folding cooperativity Phys. Chem. Chem. Phys. 12 2010 3491 3500
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 3491-3500
-
-
Tsao, D.1
Dokholyan, N.V.2
-
165
-
-
80855128904
-
Folding dynamics of Trp-cage in the presence of chemical interference and macromolecular crowding i
-
A. Samiotakis, and M.S. Cheung Folding dynamics of Trp-cage in the presence of chemical interference and macromolecular crowding I J. Chem. Phys. 135 2011 175101
-
(2011)
J. Chem. Phys.
, vol.135
, pp. 175101
-
-
Samiotakis, A.1
Cheung, M.S.2
-
166
-
-
58849112212
-
Macromolecular crowding modulates folding mechanism of alpha/beta protein apoflavodoxin
-
D. Homouz, L. Stagg, P. Wittung-Stafshede, and M.S. Cheung Macromolecular crowding modulates folding mechanism of alpha/beta protein apoflavodoxin Biophys. J. 96 2009 671 680
-
(2009)
Biophys. J.
, vol.96
, pp. 671-680
-
-
Homouz, D.1
Stagg, L.2
Wittung-Stafshede, P.3
Cheung, M.S.4
-
167
-
-
68349084565
-
Modulation of calmodulin plasticity by the effect of macromolecular crowding
-
D. Homouz, H. Sanabria, M.N. Waxham, and M.S. Cheung Modulation of calmodulin plasticity by the effect of macromolecular crowding J. Mol. Biol. 391 2009 933 943
-
(2009)
J. Mol. Biol.
, vol.391
, pp. 933-943
-
-
Homouz, D.1
Sanabria, H.2
Waxham, M.N.3
Cheung, M.S.4
-
169
-
-
34547507851
-
Effects of crowding and confinement on the structures of the transition state ensemble in proteins
-
DOI 10.1021/jp068201y
-
M.S. Cheung, and D. Thirumalai Effects of crowding and confinement on the structure of the transition state ensemble in proteins J. Phys. Chem. B. 111 2007 8250 8257 (Pubitemid 47184401)
-
(2007)
Journal of Physical Chemistry B
, vol.111
, Issue.28
, pp. 8250-8257
-
-
Cheung, M.S.1
Thirumalai, D.2
-
170
-
-
77955249021
-
Factors defining effects of macromolecular crowding on protein stability: An in vitro/in silico case study using cytochrome c
-
A. Christiansen, Q. Wang, A. Samiotakis, M.S. Cheung, and P. Wittung-Stafshede Factors defining effects of macromolecular crowding on protein stability: an in vitro/in silico case study using cytochrome c Biochemistry 49 2010 6519 6530
-
(2010)
Biochemistry
, vol.49
, pp. 6519-6530
-
-
Christiansen, A.1
Wang, Q.2
Samiotakis, A.3
Cheung, M.S.4
Wittung-Stafshede, P.5
-
171
-
-
50149092143
-
Crowded, cell-like environment induces shape changes in aspherical protein
-
D. Homouz, M. Perham, A. Samiotakis, M.S. Cheung, and P. Wittung-Stafshede Crowded, cell-like environment induces shape changes in aspherical protein PNAS 105 2008 11754 11759
-
(2008)
PNAS
, vol.105
, pp. 11754-11759
-
-
Homouz, D.1
Perham, M.2
Samiotakis, A.3
Cheung, M.S.4
Wittung-Stafshede, P.5
-
172
-
-
78049291945
-
Structure, function, and folding of phosphoglycerate kinase are strongly perturbed by macromolecular crowding
-
A. Dhar, A. Samiotakis, S. Ebbinghaus, L. Nienhaus, D. Homouz, and M. Gruebele Structure, function, and folding of phosphoglycerate kinase are strongly perturbed by macromolecular crowding PNAS 107 2010 17586 17591
-
(2010)
PNAS
, vol.107
, pp. 17586-17591
-
-
Dhar, A.1
Samiotakis, A.2
Ebbinghaus, S.3
Nienhaus, L.4
Homouz, D.5
Gruebele, M.6
-
173
-
-
36749072621
-
Manipulating biopolymer dynamics by anisotropic nanoconfinement
-
DOI 10.1021/nl071948v
-
S.Q. Zhang, and M.S. Cheung Manipulating biopolymer dynamics by anisotropic nanoconfinement Nano Lett. 7 2007 3438 3442 (Pubitemid 350216043)
-
(2007)
Nano Letters
, vol.7
, Issue.11
, pp. 3438-3442
-
-
Zhang, S.-Q.1
Cheung, M.S.2
-
174
-
-
77950518894
-
Protein folding requires crowd control in a simulated cell
-
B.R. Jefferys, L.A. Kelley, and M.J.E. Sternberg Protein folding requires crowd control in a simulated cell J. Mol. Biol. 397 2010 1329 1338
-
(2010)
J. Mol. Biol.
, vol.397
, pp. 1329-1338
-
-
Jefferys, B.R.1
Kelley, L.A.2
Sternberg, M.J.E.3
-
176
-
-
84877759822
-
Calculating the bimolecular rate of protein-protein association with interacting crowders
-
E.H. Yap, and T. Head-Gordon Calculating the bimolecular rate of protein-protein association with interacting crowders J. Chem. Theory Comput. 9 2013 2481 2489
-
(2013)
J. Chem. Theory Comput.
, vol.9
, pp. 2481-2489
-
-
Yap, E.H.1
Head-Gordon, T.2
-
177
-
-
79961136147
-
Crowding promotes the switch from hairpin to pseudoknot conformation in human telomerase RNA
-
N.A. Denesyuk, and D. Thirumalai Crowding promotes the switch from hairpin to pseudoknot conformation in human telomerase RNA J. Am. Chem. Soc. 133 2011 11858 11861
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 11858-11861
-
-
Denesyuk, N.A.1
Thirumalai, D.2
-
178
-
-
44949181944
-
Effects of trimethylamine N-Oxide (TMAO) and crowding agents on the stability of RNA hairpins
-
DOI 10.1021/ja078326w
-
D.L. Pincus, C. Hyeon, and D. Thirumalai Effects of trimethylamine N-oxide (TMAO) and crowding agents on the stability of RNA hairpins J. Am. Chem. Soc. 130 2008 7364 7372 (Pubitemid 351813229)
-
(2008)
Journal of the American Chemical Society
, vol.130
, Issue.23
, pp. 7364-7372
-
-
Pincus, D.L.1
Hyeon, C.2
Thirumalai, D.3
-
179
-
-
84870891163
-
Beads-on a-string structure of long telomeric DNAs under molecular crowding conditions
-
H.Q. Yu, X.B. Gu, S. Nakano, D. Miyoshi, and N. Sugimoto Beads-on-a-string structure of long telomeric DNAs under molecular crowding conditions J. Am. Chem. Soc. 134 2012 20060 20069
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 20060-20069
-
-
Yu, H.Q.1
Gu, X.B.2
Nakano, S.3
Miyoshi, D.4
Sugimoto, N.5
-
180
-
-
0000303810
-
Interaction between particles suspended in solutions of macromolecules
-
S. Asakura, and F. Oosawa Interaction between particles suspended in solutions of macromolecules J. Polym. Sci. 33 1958 183 192
-
(1958)
J. Polym. Sci.
, vol.33
, pp. 183-192
-
-
Asakura, S.1
Oosawa, F.2
-
181
-
-
33645999511
-
On interaction between 2 bodies immersed in a solution of macromolecules
-
S. Asakura, and F. Oosawa On interaction between 2 bodies immersed in a solution of macromolecules J. Chem. Phys. 22 1954 1255 1256
-
(1954)
J. Chem. Phys.
, vol.22
, pp. 1255-1256
-
-
Asakura, S.1
Oosawa, F.2
-
182
-
-
84861163682
-
A physics-based approach of coarse-graining the cytoplasm of Escherichia coli (CGCYTO)
-
Q. Wang, and M.S. Cheung A physics-based approach of coarse-graining the cytoplasm of Escherichia coli (CGCYTO) Biophys. J. 102 2012 2353 2361
-
(2012)
Biophys. J.
, vol.102
, pp. 2353-2361
-
-
Wang, Q.1
Cheung, M.S.2
-
183
-
-
79952937410
-
Patchy colloids: State of the art and perspectives
-
E. Bianchi, R. Blaak, and C.N. Likos Patchy colloids: state of the art and perspectives Phys. Chem. Chem. Phys. 13 2011 6397 6410
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 6397-6410
-
-
Bianchi, E.1
Blaak, R.2
Likos, C.N.3
-
184
-
-
0035819206
-
Monte Carlo simulations of lysozyme self-association in aqueous solution
-
DOI 10.1021/jp012235i
-
F. Carlsson, M. Malmsten, and P. Linse Monte Carlo simulations of lysozyme self-association in aqueous solution J. Phys. Chem. B 105 2001 12189 12195 (Pubitemid 35338378)
-
(2001)
Journal of Physical Chemistry B
, vol.105
, Issue.48
, pp. 12189-12195
-
-
Carlsson, F.1
Malmsten, M.2
Linse, P.3
-
185
-
-
0035960194
-
Monte Carlo simulations of polyelectrolyte-protein complexation
-
DOI 10.1021/jp010360o
-
F. Carlsson, P. Linse, and M. Malmsten Monte Carlo simulations of polyelectrolyte-protein complexation J. Phys. Chem. B. 105 2001 9040 9049 (Pubitemid 35338694)
-
(2001)
Journal of Physical Chemistry B
, vol.105
, Issue.38
, pp. 9040-9049
-
-
Carlsson, F.1
Linse, P.2
Malmsten, M.3
-
186
-
-
84863378536
-
Monte Carlo simulation on complex formation of proteins and polysaccharides
-
Y.Q. Li, T.F. Shi, L.J. An, and Q.R. Huang Monte Carlo simulation on complex formation of proteins and polysaccharides J. Phys. Chem. B 116 2012 3045 3053
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 3045-3053
-
-
Li, Y.Q.1
Shi, T.F.2
An, L.J.3
Huang, Q.R.4
-
187
-
-
84859221641
-
Crowding-induced phase separation of Lennard-Jones particles: Implications to nuclear structures in a biological cell
-
E.J. Cho, and J.S. Kim Crowding-induced phase separation of Lennard-Jones particles: implications to nuclear structures in a biological cell J. Phys. Chem. B. 116 2012 3874 3879
-
(2012)
J. Phys. Chem. B.
, vol.116
, pp. 3874-3879
-
-
Cho, E.J.1
Kim, J.S.2
-
188
-
-
84856473412
-
Effective interactions in lysozyme aqueous solutions: A small-angle neutron scattering and computer simulation study
-
M.C. Abramo, C. Caccamo, D. Costa, G. Pellicane, R. Ruberto, and U. Wanderlingh Effective interactions in lysozyme aqueous solutions: a small-angle neutron scattering and computer simulation study J. Chem. Phys. 136 2012 035103
-
(2012)
J. Chem. Phys.
, vol.136
, pp. 035103
-
-
Abramo, M.C.1
Caccamo, C.2
Costa, D.3
Pellicane, G.4
Ruberto, R.5
Wanderlingh, U.6
-
189
-
-
79956146854
-
Molecular dynamics and small-angle neutron scattering of lysozyme aqueous solutions
-
M.C. Abramo, C. Caccamo, M. Calvo, V.C. Nibali, D. Costa, and R. Giordano Molecular dynamics and small-angle neutron scattering of lysozyme aqueous solutions Philos. Mag. 91 2011 2066 2076
-
(2011)
Philos. Mag.
, vol.91
, pp. 2066-2076
-
-
Abramo, M.C.1
Caccamo, C.2
Calvo, M.3
Nibali, V.C.4
Costa, D.5
Giordano, R.6
-
190
-
-
77954701882
-
Molecular dynamics of an embedded-charge model of lysozyme aqueous solutions
-
M.C. Abramo, C. Caccamo, D. Costa, G. Pellicane, and R. Ruberto Molecular dynamics of an embedded-charge model of lysozyme aqueous solutions J. Phys. Chem. B 114 2010 9109 9118
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 9109-9118
-
-
Abramo, M.C.1
Caccamo, C.2
Costa, D.3
Pellicane, G.4
Ruberto, R.5
-
192
-
-
84857437094
-
Colloidal model of lysozyme aqueous solutions: A computer simulation and theoretical study
-
G. Pellicane Colloidal model of lysozyme aqueous solutions: a computer simulation and theoretical study J. Phys. Chem. B 116 2012 2114 2120
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 2114-2120
-
-
Pellicane, G.1
-
193
-
-
36148939558
-
Investigation of the phase behavior of an embedded charge protein model through molecular simulation
-
DOI 10.1021/jp075455q
-
T.W. Rosch, and J.R. Errington Investigation of the phase behavior of an embedded charge protein model through molecular simulation J. Phys. Chem. B. 111 2007 12591 12598 (Pubitemid 350103376)
-
(2007)
Journal of Physical Chemistry B
, vol.111
, Issue.43
, pp. 12591-12598
-
-
Rosch, T.W.1
Errington, J.R.2
-
194
-
-
38449108386
-
Toward realistic modeling of dynamic processes in cell signaling: Quantification of macromolecular crowding effects
-
J. Sun, and H. Weinstein Toward realistic modeling of dynamic processes in cell signaling: quantification of macromolecular crowding effects J. Chem. Phys. 127 2007 155105
-
(2007)
J. Chem. Phys.
, vol.127
, pp. 155105
-
-
Sun, J.1
Weinstein, H.2
-
196
-
-
34250321364
-
Coarse-grained strategy for modeling protein stability in concentrated solutions. III: Directional protein interactions
-
DOI 10.1529/biophysj.106.099085
-
J.K. Cheung, V.K. Shen, J.R. Errington, and T.M. Truskett Coarse-grained strategy for modeling protein stability in concentrated solutions III: Directional protein interactions Biophys. J 92 2007 4316 4324 (Pubitemid 46910546)
-
(2007)
Biophysical Journal
, vol.92
, Issue.12
, pp. 4316-4324
-
-
Cheung, J.K.1
Shen, V.K.2
Errington, J.R.3
Truskett, T.M.4
-
197
-
-
33646007703
-
Coarse-grained strategy for modeling protein stability in concentrated solutions II: Phase behavior
-
V.K. Shen, J.K. Cheung, J.R. Errington, and T.M. Truskett Coarse-grained strategy for modeling protein stability in concentrated solutions II: Phase behavior Biophys. J. 90 2006 1949 1960
-
(2006)
Biophys. J.
, vol.90
, pp. 1949-1960
-
-
Shen, V.K.1
Cheung, J.K.2
Errington, J.R.3
Truskett, T.M.4
-
198
-
-
25844471707
-
Coarse-grained strategy for modeling protein stability in concentrated solutions
-
DOI 10.1529/biophysj.105.062067
-
J.K. Cheung, and T.M. Truskett Coarse-grained strategy for modeling protein stability in concentrated solutions Biophys. J. 89 2005 2372 2384 (Pubitemid 41401027)
-
(2005)
Biophysical Journal
, vol.89
, Issue.4
, pp. 2372-2384
-
-
Cheung, J.K.1
Truskett, T.M.2
-
199
-
-
84862926002
-
Viscosity and diffusion: Crowding and salt effects in protein solutions
-
M. Heinen, F. Zanini, F. Roosen-Runge, D. Fedunova, F.J. Zhang, and M. Hennig Viscosity and diffusion: crowding and salt effects in protein solutions Soft Matter 8 2012 1404 1419
-
(2012)
Soft Matter
, vol.8
, pp. 1404-1419
-
-
Heinen, M.1
Zanini, F.2
Roosen-Runge, F.3
Fedunova, D.4
Zhang, F.J.5
Hennig, M.6
-
200
-
-
60349127442
-
QM/MM methods for biomolecular systems
-
H.M. Senn, and W. Thiel QM/MM methods for biomolecular systems Angew. Chem. Int. Ed. 48 2009 1198 1229
-
(2009)
Angew. Chem. Int. Ed.
, vol.48
, pp. 1198-1229
-
-
Senn, H.M.1
Thiel, W.2
-
201
-
-
34147179524
-
Bridging from molecular simulation to biochemical networks
-
DOI 10.1016/j.sbi.2007.03.014, PII S0959440X07000449, Theory and Simulation / Mecromolecular Assemblages
-
M. Stein, R.R. Gabdoulline, and R.C. Wade Bridging from molecular simulation to biochemical networks Curr. Opin. Struct. Biol. 17 2007 166 172 (Pubitemid 46575259)
-
(2007)
Current Opinion in Structural Biology
, vol.17
, Issue.2
, pp. 166-172
-
-
Stein, M.1
Gabdoulline, R.R.2
Wade, R.C.3
-
202
-
-
0037079054
-
Computational systems biology
-
DOI 10.1038/nature01254
-
H. Kitano Computational systems biology Nature 420 2002 206 210 (Pubitemid 35340131)
-
(2002)
Nature
, vol.420
, Issue.6912
, pp. 206-210
-
-
Kitano, H.1
-
203
-
-
60849119860
-
Biochemical simulations: Stochastic, approximate stochastic and hybrid approaches
-
J. Pahle Biochemical simulations: stochastic, approximate stochastic and hybrid approaches Brief. Bioinf. 10 2009 53 64
-
(2009)
Brief. Bioinf.
, vol.10
, pp. 53-64
-
-
Pahle, J.1
-
204
-
-
84055217487
-
Effects of macromolecular crowding on genetic networks
-
M.J. Morelli, R.J. Allen, and P.R. ten Wolde Effects of macromolecular crowding on genetic networks Biophys. J. 101 2011 2882 2891
-
(2011)
Biophys. J.
, vol.101
, pp. 2882-2891
-
-
Morelli, M.J.1
Allen, R.J.2
Ten Wolde, P.R.3
-
205
-
-
84862547300
-
A computational approach to increase time scales in Brownian dynamics-based reaction-diffusion modeling
-
Z. Frazier, and F. Alber A computational approach to increase time scales in Brownian dynamics-based reaction-diffusion modeling J. Comput. Biol. 19 2012 606 618
-
(2012)
J. Comput. Biol.
, vol.19
, pp. 606-618
-
-
Frazier, Z.1
Alber, F.2
-
206
-
-
84875784804
-
A quantitative model of ERK MAP kinase phosphorylation in crowded media
-
K. Aoki, K. Takahashi, K. Kaizu, and M. Matsuda A quantitative model of ERK MAP kinase phosphorylation in crowded media Sci. Rep. - UK 3 2013 1541
-
(2013)
Sci. Rep. - UK
, vol.3
, pp. 1541
-
-
Aoki, K.1
Takahashi, K.2
Kaizu, K.3
Matsuda, M.4
-
207
-
-
43849103490
-
Coarse-grained molecular simulation of diffusion and reaction kinetics in a crowded virtual cytoplasm
-
D. Ridgway, G. Broderick, A. Lopez-Campistrous, M. Ru'aini, P. Winter, and M. Hamilton Coarse-grained molecular simulation of diffusion and reaction kinetics in a crowded virtual cytoplasm Biophys. J. 94 2008 3748 3759
-
(2008)
Biophys. J.
, vol.94
, pp. 3748-3759
-
-
Ridgway, D.1
Broderick, G.2
Lopez-Campistrous, A.3
Ru'Aini, M.4
Winter, P.5
Hamilton, M.6
-
208
-
-
84872288144
-
High-performance stochastic simulation method for the reaction-diffusion master equation
-
E. Roberts, J.E. Stone, Z. Luthey-Schulten, and Lattice Microbes: High-performance stochastic simulation method for the reaction-diffusion master equation J. Comput. Chem. 34 2013 245 255
-
(2013)
J. Comput. Chem.
, vol.34
, pp. 245-255
-
-
Roberts, E.1
Stone, J.E.2
Luthey-Schulten, Z.3
Microbes, L.4
-
209
-
-
79953666361
-
Noise contributions in an inducible genetic switch: A whole-cell simulation study
-
E. Roberts, A. Magis, J.O. Ortiz, W. Baumeister, and Z. Luthey-Schulten Noise contributions in an inducible genetic switch: a whole-cell simulation study PLoS Comput. Biol. 7 2011 e1002010
-
(2011)
PLoS Comput. Biol.
, vol.7
, pp. 1002010
-
-
Roberts, E.1
Magis, A.2
Ortiz, J.O.3
Baumeister, W.4
Luthey-Schulten, Z.5
-
210
-
-
14844321288
-
Space in systems biology of signaling pathways - Towards intracellular molecular crowding in silico
-
DOI 10.1016/j.febslet.2005.01.072, Systems Biology
-
K. Takahashi, S.N.V. Arjunan, and M. Tomita Space in systems biology of signaling pathways - towards intracellular molecular crowding in silico FEBS Lett. 579 2005 1783 1788 (Pubitemid 40342654)
-
(2005)
FEBS Letters
, vol.579
, Issue.8
, pp. 1783-1788
-
-
Takahashi, K.1
Vel Arjunan, S.N.2
Tomita, M.3
-
211
-
-
79955815642
-
Agent-based simulation of reactions in the crowded and structured intracellular environment: Influence of mobility and location of the reactants
-
M.T. Klann, A. Lapin, and M. Reuss Agent-based simulation of reactions in the crowded and structured intracellular environment: influence of mobility and location of the reactants BMC Syst. Biol. 5 2011 71
-
(2011)
BMC Syst. Biol.
, vol.5
, pp. 71
-
-
Klann, M.T.1
Lapin, A.2
Reuss, M.3
-
212
-
-
84885862328
-
Simulating diffusion in crowded environments with multifractional Brownian motion
-
A. Leier, T.T. Marquez-Lago, and K. Burrage Simulating diffusion in crowded environments with multifractional Brownian motion FEBS J. 279 2012 524
-
(2012)
FEBS J.
, vol.279
, pp. 524
-
-
Leier, A.1
Marquez-Lago, T.T.2
Burrage, K.3
-
213
-
-
83755203610
-
Stochastic simulation for spatial modelling of dynamic processes in a living cell
-
Springer
-
K. Burrage, P.M. Burrage, A. Leier, T. Marquez-Lago, and D.V. Nicolau Stochastic simulation for spatial modelling of dynamic processes in a living cell Design and Analysis of Biomolecular Circuits:Engineering Approaches to Systems and Synthetic Biology 2011 Springer 43 62
-
(2011)
Design and Analysis of Biomolecular Circuits:Engineering Approaches to Systems and Synthetic Biology
, pp. 43-62
-
-
Burrage, K.1
Burrage, P.M.2
Leier, A.3
Marquez-Lago, T.4
Nicolau, D.V.5
-
214
-
-
77249093066
-
Spatio-temporal correlations can drastically change the response of a MAPK pathway
-
K. Takahashi, S. Tanase-Nicola, and P.R. ten Wolde Spatio-temporal correlations can drastically change the response of a MAPK pathway PNAS 107 2010 2473 2478
-
(2010)
PNAS
, vol.107
, pp. 2473-2478
-
-
Takahashi, K.1
Tanase-Nicola, S.2
Ten Wolde, P.R.3
-
215
-
-
82055163042
-
Multi-scale spatio-temporal modeling: Lifelines of microorganisms in bioreactors and tracking molecules in cells
-
A. Lapin, M. Klann, and M. Reuss Multi-scale spatio-temporal modeling: lifelines of microorganisms in bioreactors and tracking molecules in cells Adv. Biochem. Eng. Biotechnol. 121 2010 23 43
-
(2010)
Adv. Biochem. Eng. Biotechnol.
, vol.121
, pp. 23-43
-
-
Lapin, A.1
Klann, M.2
Reuss, M.3
-
216
-
-
0017030517
-
General method for numerically simulating stochastic time evolution of coupled chemical-reactions
-
D.T. Gillespie General method for numerically simulating stochastic time evolution of coupled chemical-reactions J. Comput. Phys. 22 1976 403 434
-
(1976)
J. Comput. Phys.
, vol.22
, pp. 403-434
-
-
Gillespie, D.T.1
-
217
-
-
84855830615
-
Three-dimensional stochastic off-lattice model of binding chemistry in crowded environments
-
B. Lee, P.R. LeDuc, and R. Schwartz Three-dimensional stochastic off-lattice model of binding chemistry in crowded environments PLoS One 7 2012 e30131
-
(2012)
PLoS One
, vol.7
, pp. 30131
-
-
Lee, B.1
Leduc, P.R.2
Schwartz, R.3
-
218
-
-
84855825205
-
Unified regression model of binding equilibria in crowded environments
-
B. Lee, P.R. LeDuc, and R. Schwartz Unified regression model of binding equilibria in crowded environments Sci. Rep. - UK 1 2011 97
-
(2011)
Sci. Rep. - UK
, vol.1
, pp. 97
-
-
Lee, B.1
Leduc, P.R.2
Schwartz, R.3
-
219
-
-
70350244548
-
Parameter effects on binding chemistry in crowded media using a two-dimensional stochastic off-lattice model
-
B. Lee, P.R. Leduc, and R. Schwartz Parameter effects on binding chemistry in crowded media using a two-dimensional stochastic off-lattice model Phys. Rev. E. 80 2009 041918
-
(2009)
Phys. Rev. E.
, vol.80
, pp. 041918
-
-
Lee, B.1
Leduc, P.R.2
Schwartz, R.3
-
220
-
-
52249096804
-
Stochastic off-lattice modeling of molecular self-assembly in crowded environments by Green's function reaction dynamics
-
B. Lee, P.R. LeDuc, and R. Schwartz Stochastic off-lattice modeling of molecular self-assembly in crowded environments by Green's function reaction dynamics Phys. Rev. E. 78 2008 031911
-
(2008)
Phys. Rev. E.
, vol.78
, pp. 031911
-
-
Lee, B.1
Leduc, P.R.2
Schwartz, R.3
-
221
-
-
29244454300
-
Green's-function reaction dynamics: A particle-based approach for simulating biochemical networks in time and space
-
J.S. van Zon, and P.R. ten Wolde Green's-function reaction dynamics: a particle-based approach for simulating biochemical networks in time and space J. Chem. Phys. 123 2005 234910
-
(2005)
J. Chem. Phys.
, vol.123
, pp. 234910
-
-
Van Zon, J.S.1
Ten Wolde, P.R.2
-
222
-
-
70849102021
-
Impact of genome reduction on bacterial metabolism and its regulation
-
E. Yus, T. Maier, K. Michalodimitrakis, V. van Noort, T. Yamada, and W.H. Chen Impact of genome reduction on bacterial metabolism and its regulation Science 326 2009 1263 1268
-
(2009)
Science
, vol.326
, pp. 1263-1268
-
-
Yus, E.1
Maier, T.2
Michalodimitrakis, K.3
Van Noort, V.4
Yamada, T.5
Chen, W.H.6
-
223
-
-
70849119931
-
Transcriptome complexity in a genome-reduced bacterium
-
M. Guell, V. van Noort, E. Yus, W.H. Chen, J. Leigh-Bell, and K. Michalodimitrakis Transcriptome complexity in a genome-reduced bacterium Science 326 2009 1268 1271
-
(2009)
Science
, vol.326
, pp. 1268-1271
-
-
Guell, M.1
Van Noort, V.2
Yus, E.3
Chen, W.H.4
Leigh-Bell, J.5
Michalodimitrakis, K.6
-
225
-
-
41049093757
-
Multiscale simulation of soft matter: From scale bridging to adaptive resolution
-
DOI 10.1146/annurev.physchem.59.032607.093707
-
M. Praprotnik, L. Delle Site, and K. Kremer Multiscale simulation of soft matter: from scale bridging to adaptive resolution Annu. Rev. Phys. Chem. 59 2008 545 571 (Pubitemid 351703397)
-
(2008)
Annual Review of Physical Chemistry
, vol.59
, pp. 545-571
-
-
Praprotnik, M.1
Site, L.D.2
Kremer, K.3
-
226
-
-
33947421578
-
Emerging methods for multiscale simulation of biomolecular systems
-
DOI 10.1080/00268970701256696, PII 773312987, Foundations of Molecular Modeling and Simulation FOMMS 2006
-
J.W. Chu, G.S. Ayton, S. Izvekov, and G.A. Voth Emerging methods for multiscale simulation of biomolecular systems Mol. Phys. 105 2007 167 175 (Pubitemid 46447511)
-
(2007)
Molecular Physics
, vol.105
, Issue.2-3
, pp. 167-175
-
-
Chu, J.-W.1
Ayton, G.S.2
Izvekov, S.3
Voth, G.A.4
-
227
-
-
34447515841
-
From coarse-grain to all-atom: Toward multiscale analysis of protein landscapes
-
DOI 10.1002/prot.21371
-
A.P. Heath, L. Kavraki, and C. Clementi From coarse-grain to all-atom: toward multiscale analysis of protein landscapes Proteins 68 2007 646 661 (Pubitemid 47068305)
-
(2007)
Proteins: Structure, Function and Genetics
, vol.68
, Issue.3
, pp. 646-661
-
-
Heath, A.P.1
Kavraki, L.E.2
Clementi, C.3
-
228
-
-
14544291957
-
A multiscale coarse-graining method for biomolecular systems
-
DOI 10.1021/jp044629q
-
S. Izvekov, and G.A. Voth A multiscale coarse-graining method for biomolecular systems J. Phys. Chem. B 109 2005 2469 2473 (Pubitemid 40304419)
-
(2005)
Journal of Physical Chemistry B
, vol.109
, Issue.7
, pp. 2469-2473
-
-
Izvekov, S.1
Voth, G.A.2
-
229
-
-
38549152231
-
Conformational sampling of peptides in cellular environments
-
DOI 10.1529/biophysj.107.116236
-
S. Tanizaki, J. Clifford, B.D. Connelly, and M. Feig Conformational sampling of peptides in cellular environments Biophys. J. 94 2008 747 759 (Pubitemid 351162445)
-
(2008)
Biophysical Journal
, vol.94
, Issue.3
, pp. 747-759
-
-
Tanizaki, S.1
Clifford, J.2
Connelly, B.D.3
Feig, M.4
-
231
-
-
84860370724
-
Molecular crowding and protein enzymatic dynamics
-
C. Echeverria, and R. Kapral Molecular crowding and protein enzymatic dynamics Phys. Chem. Chem. Phys. 14 2012 6755 6763
-
(2012)
Phys. Chem. Chem. Phys.
, vol.14
, pp. 6755-6763
-
-
Echeverria, C.1
Kapral, R.2
-
232
-
-
0000729781
-
Transition path sampling and the calculation of rate constants
-
C. Dellago, P.G. Bolhuis, F.S. Csajka, and D. Chandler Transition path sampling and the calculation of rate constants J. Chem. Phys. 108 1998 1964 1977 (Pubitemid 128598706)
-
(1998)
Journal of Chemical Physics
, vol.108
, Issue.5
, pp. 1964-1977
-
-
Dellago, C.1
Bolhuis, P.G.2
Csajka, F.S.3
Chandler, D.4
-
233
-
-
0037079574
-
Simulating enzyme reactions: Challenges and perspectives
-
DOI 10.1002/jcc.1156
-
M.J. Field Simulating enzyme reactions: challenges and perspectives J. Comput. Chem. 23 2002 48 58 (Pubitemid 34063129)
-
(2002)
Journal of Computational Chemistry
, vol.23
, Issue.1
, pp. 48-58
-
-
Field, M.J.1
-
234
-
-
58849115853
-
Determination of hydroxyl rate constants by a high-throughput fluorimetric assay: Towards a unified reactivity scale for antioxidants
-
G. Louit, M. Hanedanian, F. Taran, H. Coffigny, J.P. Renault, and S. Pin Determination of hydroxyl rate constants by a high-throughput fluorimetric assay: towards a unified reactivity scale for antioxidants Analyst 134 2009 250 255
-
(2009)
Analyst
, vol.134
, pp. 250-255
-
-
Louit, G.1
Hanedanian, M.2
Taran, F.3
Coffigny, H.4
Renault, J.P.5
Pin, S.6
-
235
-
-
33847770317
-
SPR microscopy and its applications to high-throughput analyses of biomolecular binding events and their kinetics
-
DOI 10.1016/j.biomaterials.2007.01.047, PII S0142961207001251
-
C.T. Campbell, and G. Kim SPR microscopy and its applications to high-throughput analyses of biomolecular binding events and their kinetics Biomaterials 28 2007 2380 2392 (Pubitemid 46389403)
-
(2007)
Biomaterials
, vol.28
, Issue.15
, pp. 2380-2392
-
-
Campbell, C.T.1
Kim, G.2
-
236
-
-
84871693479
-
Local nucleosome dynamics facilitate chromatin accessibility in living mammalian cells
-
S. Hihara, C.G. Pack, K. Kaizu, T. Tani, T. Hanafusa, and T. Nozaki Local nucleosome dynamics facilitate chromatin accessibility in living mammalian cells Cell Rep. 2 2012 1645 1656
-
(2012)
Cell Rep.
, vol.2
, pp. 1645-1656
-
-
Hihara, S.1
Pack, C.G.2
Kaizu, K.3
Tani, T.4
Hanafusa, T.5
Nozaki, T.6
-
237
-
-
63049121363
-
X-ray imaging beyond the limits
-
H.N. Chapman X-ray imaging beyond the limits Nat. Mater. 8 2009 299 301
-
(2009)
Nat. Mater.
, vol.8
, pp. 299-301
-
-
Chapman, H.N.1
|