-
1
-
-
0036880493
-
What vibrations tell us about proteins
-
Barth, A.; Zscherp, C. What vibrations tell us about proteins Q. Rev. Biophys. 2002, 35, 369-430
-
(2002)
Q. Rev. Biophys.
, vol.35
, pp. 369-430
-
-
Barth, A.1
Zscherp, C.2
-
2
-
-
44949247333
-
Molecular design of beta-hairpin peptides for material construction
-
Rughani, R. V.; Schneider, J. P. Molecular design of beta-hairpin peptides for material construction MRS Bull. 2008, 33, 530-535
-
(2008)
MRS Bull.
, vol.33
, pp. 530-535
-
-
Rughani, R.V.1
Schneider, J.P.2
-
3
-
-
43949086047
-
Thermoreversible lysozyme hydrogels: Properties and an insight into the gelation pathway
-
Yan, H.; Frielinghaus, H.; Nykanen, A.; Ruokolainen, J.; Saiani, A.; Miller, A. F. Thermoreversible lysozyme hydrogels: properties and an insight into the gelation pathway Soft Matter 2008, 4, 1313-1325
-
(2008)
Soft Matter
, vol.4
, pp. 1313-1325
-
-
Yan, H.1
Frielinghaus, H.2
Nykanen, A.3
Ruokolainen, J.4
Saiani, A.5
Miller, A.F.6
-
4
-
-
11344272213
-
Local amide i mode frequencies and coupling constants in multiple-stranded antiparallel β-sheet polypeptides
-
Lee, C.; Cho, M. Local amide I mode frequencies and coupling constants in multiple-stranded antiparallel β-sheet polypeptides J. Phys. Chem. B 2004, 108, 20397-20407
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 20397-20407
-
-
Lee, C.1
Cho, M.2
-
5
-
-
24644503134
-
Characteristic two-dimensional IR spectroscopic features of antiparallel and parallel β-sheet polypeptides: Simulation studies
-
Hahn, S.; Kim, S.-S.; Lee, C.; Cho, M. Characteristic two-dimensional IR spectroscopic features of antiparallel and parallel β-sheet polypeptides: Simulation studies J. Chem. Phys. 2005, 123, 084905-084905-10
-
(2005)
J. Chem. Phys.
, vol.123
, pp. 08490500-08490510
-
-
Hahn, S.1
Kim, S.-S.2
Lee, C.3
Cho, M.4
-
6
-
-
42449110311
-
Amide i two-dimensional infrared spectroscopy of proteins
-
Ganim, Z.; Chung, H. S.; Smith, A. W.; DeFlores, L. P.; Jones, K. C.; Tokmakoff, A. Amide I two-dimensional infrared spectroscopy of proteins Acc. Chem. Res. 2008, 41, 432-441
-
(2008)
Acc. Chem. Res.
, vol.41
, pp. 432-441
-
-
Ganim, Z.1
Chung, H.S.2
Smith, A.W.3
Deflores, L.P.4
Jones, K.C.5
Tokmakoff, A.6
-
7
-
-
2442589387
-
Signatures of β-sheet secondary structures in linear and two-dimensional infrared spectroscopy
-
Cheatum, C. M.; Tokmakoff, A.; Knoester, J. Signatures of β-sheet secondary structures in linear and two-dimensional infrared spectroscopy J. Chem. Phys. 2004, 120, 8201-8215
-
(2004)
J. Chem. Phys.
, vol.120
, pp. 8201-8215
-
-
Cheatum, C.M.1
Tokmakoff, A.2
Knoester, J.3
-
8
-
-
66149123289
-
Folding, self-assembly, and bulk material properties of a de novo designed three-stranded β-sheet hydrogel
-
Rughani, R. V.; Salick, D. A.; Lamm, M. S.; Yucel, T.; Pochan, D. J.; Schneider, J. P. Folding, self-assembly, and bulk material properties of a de novo designed three-stranded β-sheet hydrogel Biomacromolecules 2009, 10, 1295-1304
-
(2009)
Biomacromolecules
, vol.10
, pp. 1295-1304
-
-
Rughani, R.V.1
Salick, D.A.2
Lamm, M.S.3
Yucel, T.4
Pochan, D.J.5
Schneider, J.P.6
-
9
-
-
33750084721
-
Aggregation of the amphipathic peptides (AAKA)n into antiparallel β-sheets
-
Measey, T. J.; Schweitzer-Stenner, R. Aggregation of the amphipathic peptides (AAKA)n into antiparallel β-sheets J. Am. Chem. Soc. 2006, 128, 13324-13325
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 13324-13325
-
-
Measey, T.J.1
Schweitzer-Stenner, R.2
-
10
-
-
73249133310
-
Self-aggregation of a polyalanine octamer promoted by its C-terminal tyrosine and probed by a strongly enhanced vibrational circular dichroism signal
-
Measey, T. J.; Smith, K. B.; Decatur, S. M.; Zhao, L.; Yang, G.; Schweitzer-Stenner, R. Self-aggregation of a polyalanine octamer promoted by its C-terminal tyrosine and probed by a strongly enhanced vibrational circular dichroism signal J. Am. Chem. Soc. 2009, 131, 18218-18219
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 18218-18219
-
-
Measey, T.J.1
Smith, K.B.2
Decatur, S.M.3
Zhao, L.4
Yang, G.5
Schweitzer-Stenner, R.6
-
11
-
-
0037132592
-
Responsive hydrogels from the intramolecular folding and self-assembly of a designed peptide
-
Schneider, J. P.; Pochan, D. J.; Ozbas, B.; Rajagopal, K.; Pakstis, L.; Kretsinger, J. Responsive hydrogels from the intramolecular folding and self-assembly of a designed peptide J. Am. Chem. Soc. 2002, 124, 15030-15037
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 15030-15037
-
-
Schneider, J.P.1
Pochan, D.J.2
Ozbas, B.3
Rajagopal, K.4
Pakstis, L.5
Kretsinger, J.6
-
12
-
-
77953306524
-
A pi-conjugated hydrogel based on an Fmoc-dipeptide naphthalene diimide semiconductor
-
Shao, H.; Parquette, J. R. A pi-conjugated hydrogel based on an Fmoc-dipeptide naphthalene diimide semiconductor Chem. Commun. 2010, 46, 4285-4287
-
(2010)
Chem. Commun.
, vol.46
, pp. 4285-4287
-
-
Shao, H.1
Parquette, J.R.2
-
13
-
-
84856481596
-
The rheological and structural properties of Fmoc-peptide-based hydrogels: The effect of aromatic molecular architecture on self-assembly and physical characteristics
-
Orbach, R.; Mironi-Harpaz, I.; Adler-Abramovich, L.; Mossou, E.; Mitchell, E. P.; Forsyth, V. T.; Gazit, E.; Seliktar, D. The rheological and structural properties of Fmoc-peptide-based hydrogels: the effect of aromatic molecular architecture on self-assembly and physical characteristics Langmuir 2012, 28, 2015-2022
-
(2012)
Langmuir
, vol.28
, pp. 2015-2022
-
-
Orbach, R.1
Mironi-Harpaz, I.2
Adler-Abramovich, L.3
Mossou, E.4
Mitchell, E.P.5
Forsyth, V.T.6
Gazit, E.7
Seliktar, D.8
-
14
-
-
78649506003
-
Biocatalytic induction of supramolecular order
-
Hirst, A. R.; Roy, S.; Arora, M.; Das, A. K.; Hodson, N.; Murray, P.; Marshall, S.; Javid, N.; Sefcik, J.; Boekhoven, J.; Van Esch, J. H.; Santabarbara, S.; Hunt, N. T.; Ulijn, R. V. Biocatalytic induction of supramolecular order Nat. Chem. 2010, 2, 1089-1094
-
(2010)
Nat. Chem.
, vol.2
, pp. 1089-1094
-
-
Hirst, A.R.1
Roy, S.2
Arora, M.3
Das, A.K.4
Hodson, N.5
Murray, P.6
Marshall, S.7
Javid, N.8
Sefcik, J.9
Boekhoven, J.10
Van Esch, J.H.11
Santabarbara, S.12
Hunt, N.T.13
Ulijn, R.V.14
-
15
-
-
77953248481
-
An investigation of the conductivity of peptide nanotube networks prepared by enzyme-triggered self-assembly
-
Xu, H. X.; Das, A. K.; Horie, M.; Shaik, M. S.; Smith, A. M.; Luo, Y.; Lu, X. F.; Collins, R.; Liem, S. Y.; Song, A. M.; Popelier, P. L. A.; Turner, M. L.; Xiao, P.; Kinloch, I. A.; Ulijn, R. V. An investigation of the conductivity of peptide nanotube networks prepared by enzyme-triggered self-assembly Nanoscale 2010, 2, 960-966
-
(2010)
Nanoscale
, vol.2
, pp. 960-966
-
-
Xu, H.X.1
Das, A.K.2
Horie, M.3
Shaik, M.S.4
Smith, A.M.5
Luo, Y.6
Lu, X.F.7
Collins, R.8
Liem, S.Y.9
Song, A.M.10
Popelier, P.L.A.11
Turner, M.L.12
Xiao, P.13
Kinloch, I.A.14
Ulijn, R.V.15
-
16
-
-
60649121345
-
Introducing chemical functionality in Fmoc-peptide gels for cell culture
-
Jayawarna, V.; Richardson, S. M.; Hirst, A. R.; Hodson, N. W.; Saiani, A.; Gough, J. E.; Ulijn, R. V. Introducing chemical functionality in Fmoc-peptide gels for cell culture Acta Biomater. 2009, 5, 934-943
-
(2009)
Acta Biomater.
, vol.5
, pp. 934-943
-
-
Jayawarna, V.1
Richardson, S.M.2
Hirst, A.R.3
Hodson, N.W.4
Saiani, A.5
Gough, J.E.6
Ulijn, R.V.7
-
17
-
-
77950590085
-
Hydrogelation through self-assembly of fmoc-peptide functionalized cationic amphiphiles: Potent antibacterial agent
-
Debnath, S.; Shome, A.; Das, D.; Das, P. K. Hydrogelation through self-assembly of fmoc-peptide functionalized cationic amphiphiles: potent antibacterial agent J. Phys. Chem. B 2010, 114, 4407-4415
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 4407-4415
-
-
Debnath, S.1
Shome, A.2
Das, D.3
Das, P.K.4
-
18
-
-
58149231006
-
Enzyme-assisted self-assembly under thermodynamic control
-
Williams, R. J.; Smith, A. M.; Collins, R.; Hodson, N.; Das, A. K.; Ulijn, R. V. Enzyme-assisted self-assembly under thermodynamic control Nat. Nanotechnol. 2009, 4, 19-24
-
(2009)
Nat. Nanotechnol.
, vol.4
, pp. 19-24
-
-
Williams, R.J.1
Smith, A.M.2
Collins, R.3
Hodson, N.4
Das, A.K.5
Ulijn, R.V.6
-
19
-
-
38449096286
-
Fmoc-diphenylalanine self assembles to a hydrogel via a novel architecture based on pi-pi interlocked beta-sheets
-
Smith, A. M.; Williams, R. J.; Tang, C.; Coppo, P.; Collins, R. F.; Turner, M. L.; Saiani, A.; Ulijn, R. V. Fmoc-diphenylalanine self assembles to a hydrogel via a novel architecture based on pi-pi interlocked beta-sheets Adv. Mater. 2008, 20, 37-38
-
(2008)
Adv. Mater.
, vol.20
, pp. 37-38
-
-
Smith, A.M.1
Williams, R.J.2
Tang, C.3
Coppo, P.4
Collins, R.F.5
Turner, M.L.6
Saiani, A.7
Ulijn, R.V.8
-
20
-
-
79952584547
-
Tuning the self-assembly of the bioactive dipeptide l-carnosine by incorporation of a bulky aromatic substituent
-
Castelletto, V.; Cheng, G.; Greenland, B. W.; Hamley, I. W.; Harris, P. J. F. Tuning the self-assembly of the bioactive dipeptide l-carnosine by incorporation of a bulky aromatic substituent Langmuir 2011, 27, 2980-2988
-
(2011)
Langmuir
, vol.27
, pp. 2980-2988
-
-
Castelletto, V.1
Cheng, G.2
Greenland, B.W.3
Hamley, I.W.4
Harris, P.J.F.5
-
21
-
-
77249087365
-
Coassembly of oppositely charged short peptides into well-defined supramolecular hydrogels
-
Xu, X.-D.; Chen, C.-S.; Lu, B.; Cheng, S.-X.; Zhang, X.-Z.; Zhuo, R.-X. Coassembly of oppositely charged short peptides into well-defined supramolecular hydrogels J. Phys. Chem. B 2010, 114, 2365-2372
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 2365-2372
-
-
Xu, X.-D.1
Chen, C.-S.2
Lu, B.3
Cheng, S.-X.4
Zhang, X.-Z.5
Zhuo, R.-X.6
-
22
-
-
68649108646
-
Fmoc-diphenylalanine self-assembly mechanism induces apparent pKa shifts
-
Tang, C.; Smith, A. M.; Collins, R. F.; Ulijn, R. V.; Saiani, A. Fmoc-diphenylalanine self-assembly mechanism induces apparent pKa shifts Langmuir 2009, 25, 9447-9453
-
(2009)
Langmuir
, vol.25
, pp. 9447-9453
-
-
Tang, C.1
Smith, A.M.2
Collins, R.F.3
Ulijn, R.V.4
Saiani, A.5
-
23
-
-
82455172070
-
Effect of glycine substitution on Fmoc-diphenylalanine self-assembly and gelation properties
-
Tang, C.; Ulijn, R. V.; Saiani, A. Effect of glycine substitution on Fmoc-diphenylalanine self-assembly and gelation properties Langmuir 2011, 27, 14438-14449
-
(2011)
Langmuir
, vol.27
, pp. 14438-14449
-
-
Tang, C.1
Ulijn, R.V.2
Saiani, A.3
-
24
-
-
70349191453
-
Self-assembled Fmoc-peptides as a platform for the formation of nanostructures and hydrogels
-
Orbach, R.; Adler-Abramovich, L.; Zigerson, S.; Mironi-Harpaz, I.; Seliktar, D.; Gazit, E. Self-assembled Fmoc-peptides as a platform for the formation of nanostructures and hydrogels Biomacromolecules 2009, 10, 2646-2651
-
(2009)
Biomacromolecules
, vol.10
, pp. 2646-2651
-
-
Orbach, R.1
Adler-Abramovich, L.2
Zigerson, S.3
Mironi-Harpaz, I.4
Seliktar, D.5
Gazit, E.6
-
25
-
-
77950591477
-
Hydrogelation and self-assembly of Fmoc-tripeptides: Unexpected influence of sequence on self-assembled fibril structure, and hydrogel modulus and anisotropy
-
Cheng, G.; Castelletto, V.; Moulton, C. M.; Newby, G. E.; Hamley, I. W. Hydrogelation and self-assembly of Fmoc-tripeptides: unexpected influence of sequence on self-assembled fibril structure, and hydrogel modulus and anisotropy Langmuir 2010, 26, 4990-4998
-
(2010)
Langmuir
, vol.26
, pp. 4990-4998
-
-
Cheng, G.1
Castelletto, V.2
Moulton, C.M.3
Newby, G.E.4
Hamley, I.W.5
-
26
-
-
79959969396
-
Rational molecular design of stimulus-responsive supramolecular hydrogels based on dipeptides
-
Ikeda, M.; Tanida, T.; Yoshii, T.; Hamachi, I. Rational molecular design of stimulus-responsive supramolecular hydrogels based on dipeptides Adv. Mater. 2011, 23, 2819-2822
-
(2011)
Adv. Mater.
, vol.23
, pp. 2819-2822
-
-
Ikeda, M.1
Tanida, T.2
Yoshii, T.3
Hamachi, I.4
-
27
-
-
84869030248
-
Experimental and computational studies reveal an alternative supramolecular structure for Fmoc-dipeptide self-assembly
-
Mu, X.; Eckes, K. M.; Nguyen, M. M.; Suggs, L. J.; Ren, P. Experimental and computational studies reveal an alternative supramolecular structure for Fmoc-dipeptide self-assembly Biomacromolecules 2012, 13, 3562-3571
-
(2012)
Biomacromolecules
, vol.13
, pp. 3562-3571
-
-
Mu, X.1
Eckes, K.M.2
Nguyen, M.M.3
Suggs, L.J.4
Ren, P.5
-
28
-
-
84881064910
-
-
unpublished work where various linkers were used linking peptide and aromatic components
-
Fleming, S.; Ulijn, R. V., et al., unpublished work where various linkers were used linking peptide and aromatic components.
-
-
-
Fleming, S.1
Ulijn, R.V.2
-
29
-
-
0000065810
-
Introduction of 9-fluorenylmethyloxycarbonyl, trichloroethoxycarbonyl, and benzyloxycarbonyl amine protecting groups into O-unprotected hydroxyamino acids using succinimidyl carbonates
-
Paquet, A. Introduction of 9-fluorenylmethyloxycarbonyl, trichloroethoxycarbonyl, and benzyloxycarbonyl amine protecting groups into O-unprotected hydroxyamino acids using succinimidyl carbonates Can. J. Chem. 1982, 60, 976-980
-
(1982)
Can. J. Chem.
, vol.60
, pp. 976-980
-
-
Paquet, A.1
-
30
-
-
0027587588
-
Phase studies of a urethane model compound and polyether macroglycols by infrared spectroscopy and the relationship between eutectic composition of soft segment and blood compatibility
-
Isama, K.; Kojima, S.; Nakamura, A. Phase studies of a urethane model compound and polyether macroglycols by infrared spectroscopy and the relationship between eutectic composition of soft segment and blood compatibility J. Biomed. Mater. Res. 1993, 27, 539-545
-
(1993)
J. Biomed. Mater. Res.
, vol.27
, pp. 539-545
-
-
Isama, K.1
Kojima, S.2
Nakamura, A.3
-
31
-
-
0031104423
-
Analytical techniques for solid-phase organic and combinatorial synthesis
-
Egner, B. J.; Bradley, M. Analytical techniques for solid-phase organic and combinatorial synthesis Drug Discovery Today 1997, 2, 102-109
-
(1997)
Drug Discovery Today
, vol.2
, pp. 102-109
-
-
Egner, B.J.1
Bradley, M.2
-
32
-
-
33744495508
-
Experimental and theoretical investigation of the IR spectra and thermochemistry of four isomers of 2-N,N-dimethylaminecyclohexyl 1-N′,N′-dimethylcarbamate
-
Jalbout, A. F.; Xin-Hua, L.; Trzaskowski, B.; Raissi, H. Experimental and theoretical investigation of the IR spectra and thermochemistry of four isomers of 2-N,N-dimethylaminecyclohexyl 1-N′,N′-dimethylcarbamate Ecletica Quim. 2006, 31, 53-62
-
(2006)
Ecletica Quim.
, vol.31
, pp. 53-62
-
-
Jalbout, A.F.1
Xin-Hua, L.2
Trzaskowski, B.3
Raissi, H.4
-
33
-
-
80051731148
-
Modeling of isomeric structure of diphenyl urethane by FT-IR spectroscopy during synthesis from phenylisocyanate and phenol as an inverse kinetic problem
-
Spegazzini, N.; Siesler, H. W.; Ozaki, Y. Modeling of isomeric structure of diphenyl urethane by FT-IR spectroscopy during synthesis from phenylisocyanate and phenol as an inverse kinetic problem J. Phys. Chem. A 2011, 115, 8832-8844
-
(2011)
J. Phys. Chem. A
, vol.115
, pp. 8832-8844
-
-
Spegazzini, N.1
Siesler, H.W.2
Ozaki, Y.3
-
34
-
-
84867579583
-
Vibrational spectroscopy of self-assembling aromatic peptide derivates
-
Nuansing, W.; Rebollo, A.; Mercero, J. M.; Zuñiga, J. Vibrational spectroscopy of self-assembling aromatic peptide derivates J. Raman Spectrosc. 2012, 43, 1397-1406
-
(2012)
J. Raman Spectrosc.
, vol.43
, pp. 1397-1406
-
-
Nuansing, W.1
Rebollo, A.2
Mercero, J.M.3
Zuñiga, J.4
-
35
-
-
36449001245
-
Model calculations on the amide-I infrared bands of globular proteins
-
Torii, H.; Tasumi, M. Model calculations on the amide-I infrared bands of globular proteins J. Chem. Phys. 1992, 96, 3379-3387
-
(1992)
J. Chem. Phys.
, vol.96
, pp. 3379-3387
-
-
Torii, H.1
Tasumi, M.2
-
36
-
-
0035814332
-
Differentiation of β-sheet-forming structures: Ab initio-based simulations of IR absorption and vibrational CD for model peptide and protein β-sheets
-
Kubelka, J.; Keiderling, T. A. Differentiation of β-sheet-forming structures: ab initio-based simulations of IR absorption and vibrational CD for model peptide and protein β-sheets J. Am. Chem. Soc. 2001, 123, 12048-12058
-
(2001)
J. Am. Chem. Soc.
, vol.123
, pp. 12048-12058
-
-
Kubelka, J.1
Keiderling, T.A.2
-
37
-
-
0001934802
-
Ab initio molecular orbital study of the amide i vibrational interactions between the peptide groups in di- and tripeptides and considerations on the conformation of the extended helix
-
Torii, H.; Tasumi, M. Ab initio molecular orbital study of the amide I vibrational interactions between the peptide groups in di- and tripeptides and considerations on the conformation of the extended helix J. Raman Spectrosc. 1998, 29, 81-86
-
(1998)
J. Raman Spectrosc.
, vol.29
, pp. 81-86
-
-
Torii, H.1
Tasumi, M.2
-
38
-
-
33750559983
-
Semiempirical GGA-type density functional constructed with a long-range dispersion correction
-
Grimme, S. Semiempirical GGA-type density functional constructed with a long-range dispersion correction J. Comput. Chem. 2006, 27, 1787-1799
-
(2006)
J. Comput. Chem.
, vol.27
, pp. 1787-1799
-
-
Grimme, S.1
-
39
-
-
26344435738
-
Fully optimized contracted Gaussian basis sets for atoms Li to Kr
-
Schäfer, A.; Horn, H.; Ahlrichs, R. Fully optimized contracted Gaussian basis sets for atoms Li to Kr J. Chem. Phys. 1992, 97, 2571-2577
-
(1992)
J. Chem. Phys.
, vol.97
, pp. 2571-2577
-
-
Schäfer, A.1
Horn, H.2
Ahlrichs, R.3
-
40
-
-
0038617492
-
Fast evaluation of the Coulomb potential for electron densities using multipole accelerated resolution of identity approximation
-
Sierka, M.; Hogekamp, A.; Ahlrichs, R. Fast evaluation of the Coulomb potential for electron densities using multipole accelerated resolution of identity approximation J. Chem. Phys. 2003, 118, 9136-9148
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 9136-9148
-
-
Sierka, M.1
Hogekamp, A.2
Ahlrichs, R.3
-
41
-
-
4243539377
-
Electronic structure calculations on workstation computers: The program system turbomole
-
Ahlrichs, R.; Bär, M.; Häser, M.; Horn, H.; Kölmel, C. Electronic structure calculations on workstation computers: The program system turbomole Chem. Phys. Lett. 1989, 162, 165-169
-
(1989)
Chem. Phys. Lett.
, vol.162
, pp. 165-169
-
-
Ahlrichs, R.1
Bär, M.2
Häser, M.3
Horn, H.4
Kölmel, C.5
-
42
-
-
75749083809
-
-
Gaussian, Inc. Wallingford, CT.
-
Gaussian 09, Revision A.02: Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, Jr., J. A.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, J. M.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, Ö.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian, Inc.: Wallingford, CT, 2009.
-
(2009)
Gaussian 09, Revision A.02
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Scalmani, G.7
Barone, V.8
Mennucci, B.9
Petersson, G.A.10
Nakatsuji, H.11
Caricato, M.12
Li, X.13
Hratchian, H.P.14
Izmaylov, A.F.15
Bloino, J.16
Zheng, G.17
Sonnenberg, J.L.18
Hada, M.19
Ehara, M.20
Toyota, K.21
Fukuda, R.22
Hasegawa, J.23
Ishida, M.24
Nakajima, T.25
Honda, Y.26
Kitao, O.27
Nakai, H.28
Vreven, T.29
Montgomery, Jr.J.A.30
Peralta, J.E.31
Ogliaro, F.32
Bearpark, M.33
Heyd, J.J.34
Brothers, E.35
Kudin, K.N.36
Staroverov, V.N.37
Kobayashi, R.38
Normand, J.39
Raghavachari, K.40
Rendell, A.41
Burant, J.C.42
Iyengar, S.S.43
Tomasi, J.44
Cossi, M.45
Rega, N.46
Millam, J.M.47
Klene, M.48
Knox, J.E.49
Cross, J.B.50
Bakken, V.51
Adamo, C.52
Jaramillo, J.53
Gomperts, R.54
Stratmann, R.E.55
Yazyev, O.56
Austin, A.J.57
Cammi, R.58
Pomelli, C.59
Ochterski, J.W.60
Martin, R.L.61
Morokuma, K.62
Zakrzewski, V.G.63
Voth, G.A.64
Salvador, P.65
Dannenberg, J.J.66
Dapprich, S.67
Daniels, A.D.68
Farkas, Ö.69
Foresman, J.B.70
Ortiz, J.V.71
Cioslowski, J.72
Fox, D.J.73
more..
-
43
-
-
79952117873
-
TmoleX - A graphical user interface for TURBOMOLE
-
Steffen, C.; Thomas, K.; Huniar, U.; Hellweg, A.; Rubner, O.; Schroer, A. TmoleX-A graphical user interface for TURBOMOLE J. Comput. Chem. 2010, 31, 2967-2970
-
(2010)
J. Comput. Chem.
, vol.31
, pp. 2967-2970
-
-
Steffen, C.1
Thomas, K.2
Huniar, U.3
Hellweg, A.4
Rubner, O.5
Schroer, A.6
-
44
-
-
84861147695
-
Sequence/structure relationships in aromatic dipeptide hydrogels formed under thermodynamic control by enzyme-assisted self-assembly
-
Hughes, M.; Frederix, P. W. J. M.; Raeburn, J.; Birchall, L. S.; Sadownik, J.; Coomer, F. C.; Lin, I.-H.; Cussen, E. J.; Hunt, N. T.; Tuttle, T.; Webb, S. J.; Adams, D. J.; Ulijn, R. V. Sequence/structure relationships in aromatic dipeptide hydrogels formed under thermodynamic control by enzyme-assisted self-assembly Soft Matter 2012, 8, 5595
-
(2012)
Soft Matter
, vol.8
, pp. 5595
-
-
Hughes, M.1
Frederix, P.W.J.M.2
Raeburn, J.3
Birchall, L.S.4
Sadownik, J.5
Coomer, F.C.6
Lin, I.-H.7
Cussen, E.J.8
Hunt, N.T.9
Tuttle, T.10
Webb, S.J.11
Adams, D.J.12
Ulijn, R.V.13
-
45
-
-
84867370479
-
Encapsulating [FeFe]-hydrogenase model compounds in peptide hydrogels dramatically modifies stability and photochemistry
-
Frederix, P. W. J. M.; Kania, R.; Wright, J. A.; Lamprou, D. A.; Ulijn, R. V.; Pickett, C. J.; Hunt, N. T. Encapsulating [FeFe]-hydrogenase model compounds in peptide hydrogels dramatically modifies stability and photochemistry Dalton Trans. 2012, 41, 13112-13119
-
(2012)
Dalton Trans.
, vol.41
, pp. 13112-13119
-
-
Frederix, P.W.J.M.1
Kania, R.2
Wright, J.A.3
Lamprou, D.A.4
Ulijn, R.V.5
Pickett, C.J.6
Hunt, N.T.7
-
46
-
-
0024291319
-
13C:O labeled phospholipids hydrogen bonding to carbonyl groups
-
13C:O labeled phospholipids hydrogen bonding to carbonyl groups Biochemistry 1988, 27, 8239-8249
-
(1988)
Biochemistry
, vol.27
, pp. 8239-8249
-
-
Blume, A.1
Huebner, W.2
Messner, G.3
-
47
-
-
84859612417
-
Environment polarity in proteins mapped noninvasively by FTIR spectroscopy
-
Manor, J.; Feldblum, E. S.; Zanni, M. T.; Arkin, I. T. Environment polarity in proteins mapped noninvasively by FTIR spectroscopy J. Phys. Chem. Lett. 2012, 3, 939-944
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 939-944
-
-
Manor, J.1
Feldblum, E.S.2
Zanni, M.T.3
Arkin, I.T.4
-
48
-
-
79851507329
-
Vibrational circular dichroism as a probe of fibrillogenesis. The origin of the anomalous intensity enhancement of amyloid-like fibrils
-
Measey, T. J.; Schweitzer-Stenner, R. Vibrational circular dichroism as a probe of fibrillogenesis. The origin of the anomalous intensity enhancement of amyloid-like fibrils J. Am. Chem. Soc. 2011, 133, 1066-1076
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 1066-1076
-
-
Measey, T.J.1
Schweitzer-Stenner, R.2
-
49
-
-
84859736655
-
Simulated IR, isotropic and anisotropic Raman, and vibrational circular dichroism amide i band profiles of stacked β-sheets
-
Schweitzer-Stenner, R. Simulated IR, isotropic and anisotropic Raman, and vibrational circular dichroism amide I band profiles of stacked β-sheets J. Phys. Chem. B 2012, 116, 4141-4153
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 4141-4153
-
-
Schweitzer-Stenner, R.1
-
50
-
-
84869428877
-
Parallel β-sheet vibrational couplings revealed by 2D IR spectroscopy of an isotopically labeled macrocycle: Quantitative benchmark for the interpretation of amyloid and protein infrared spectra
-
Woys, A. M.; Almeida, A. M.; Wang, L.; Chiu, C.-C.; McGovern, M.; De Pablo, J. J.; Skinner, J. L.; Gellman, S. H.; Zanni, M. T. Parallel β-sheet vibrational couplings revealed by 2D IR spectroscopy of an isotopically labeled macrocycle: quantitative benchmark for the interpretation of amyloid and protein infrared spectra J. Am. Chem. Soc. 2012, 134, 19118-19128
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 19118-19128
-
-
Woys, A.M.1
Almeida, A.M.2
Wang, L.3
Chiu, C.-C.4
McGovern, M.5
De Pablo, J.J.6
Skinner, J.L.7
Gellman, S.H.8
Zanni, M.T.9
-
51
-
-
68949119703
-
2D-IR spectroscopy: Ultrafast insights into biomolecule structure and function
-
Hunt, N. T. 2D-IR spectroscopy: ultrafast insights into biomolecule structure and function Chem. Soc. Rev. 2009, 38, 1837-1848
-
(2009)
Chem. Soc. Rev.
, vol.38
, pp. 1837
-
-
Hunt, N.T.1
|