-
1
-
-
0347479229
-
Molecular Basis of Bacterial Outer Membrane Permeability Revisited
-
Nikaido, H. Molecular Basis of Bacterial Outer Membrane Permeability Revisited Microbiol. Mol. Biol. Rev. 2003, 67, 593-656 10.1128/MMBR.67.4.593-656.2003
-
(2003)
Microbiol. Mol. Biol. Rev.
, vol.67
, pp. 593-656
-
-
Nikaido, H.1
-
2
-
-
56649099192
-
The Crystal Structure of Mouse VDAC1 at 2.3 A Resolution Reveals Mechanistic Insights into Metabolite Gating
-
Ujwal, R.; Cascio, D.; Colletier, J.-P.; Faham, S.; Zhang, J.; Toro, L.; Ping, P.; Abramson, J. The Crystal Structure of Mouse VDAC1 at 2.3 A Resolution Reveals Mechanistic Insights into Metabolite Gating Proc. Natl. Acad. Sci. U. S. A. 2008, 105, 17742-17747 10.1073/pnas.0809634105
-
(2008)
Proc. Natl. Acad. Sci. U. S. A.
, vol.105
, pp. 17742-17747
-
-
Ujwal, R.1
Cascio, D.2
Colletier, J.-P.3
Faham, S.4
Zhang, J.5
Toro, L.6
Ping, P.7
Abramson, J.8
-
3
-
-
84905400486
-
Charged Residues Distribution Modulates Selectivity of the Open State of Human Isoforms of the Voltage Dependent Anion-Selective Channel
-
Amodeo, G. F.; Scorciapino, M. A.; Messina, A.; De Pinto, V.; Ceccarelli, M. Charged Residues Distribution Modulates Selectivity of the Open State of Human Isoforms of the Voltage Dependent Anion-Selective Channel PLoS One 2014, 9, e103879 10.1371/journal.pone.0103879
-
(2014)
PLoS One
, vol.9
, pp. e103879
-
-
Amodeo, G.F.1
Scorciapino, M.A.2
Messina, A.3
De Pinto, V.4
Ceccarelli, M.5
-
4
-
-
84930958528
-
Outer-Membrane Translocation of Bulky Small Molecules by Passive Diffusion
-
van den Berg, B.; Prathyusha Bhamidimarri, S.; Dahyabhai Prajapati, J.; Kleinekathöfer, U.; Winterhalter, M. Outer-Membrane Translocation of Bulky Small Molecules by Passive Diffusion Proc. Natl. Acad. Sci. U. S. A. 2015, 112, E2991-E2999 10.1073/pnas.1424835112
-
(2015)
Proc. Natl. Acad. Sci. U. S. A.
, vol.112
, pp. E2991-E2999
-
-
Van Den Berg, B.1
Prathyusha Bhamidimarri, S.2
Dahyabhai Prajapati, J.3
Kleinekathöfer, U.4
Winterhalter, M.5
-
5
-
-
34948868950
-
A Biological Porin Engineered into a Molecular, Nanofluidic Diode
-
Miedema, H.; Vrouenraets, M.; Wierenga, J.; Meijberg, W.; Robillard, G.; Eisenberg, B. A Biological Porin Engineered into a Molecular, Nanofluidic Diode Nano Lett. 2007, 7, 2886-2891 10.1021/nl0716808
-
(2007)
Nano Lett.
, vol.7
, pp. 2886-2891
-
-
Miedema, H.1
Vrouenraets, M.2
Wierenga, J.3
Meijberg, W.4
Robillard, G.5
Eisenberg, B.6
-
6
-
-
84958092458
-
Molecular Basis of Filtering Carbapenems by Porins from β-Lactam-Resistant Clinical Strains of Escherichia coli
-
Bajaj, H.; Scorciapino, M. A.; Moynié, L.; Page, M. G. P.; Naismith, J. H.; Ceccarelli, M.; Winterhalter, M. Molecular Basis of Filtering Carbapenems by Porins from β-Lactam-Resistant Clinical Strains of Escherichia Coli J. Biol. Chem. 2016, 291, 2837 10.1074/jbc.M115.690156
-
(2016)
J. Biol. Chem.
, vol.291
, pp. 2837
-
-
Bajaj, H.1
Scorciapino, M.A.2
Moynié, L.3
Page, M.G.P.4
Naismith, J.H.5
Ceccarelli, M.6
Winterhalter, M.7
-
7
-
-
84977090561
-
Exploiting the Porin Pathway for Polar Compound Delivery into Gram-Negative Bacteria
-
Scorciapino, M. A.; D'Agostino, T.; Acosta-Gutierrez, S.; Malloci, G.; Bodrenko, I.; Ceccarelli, M. Exploiting the Porin Pathway for Polar Compound Delivery into Gram-Negative Bacteria Future Med. Chem. 2016, 8, 1047-1062 10.4155/fmc-2016-0038
-
(2016)
Future Med. Chem.
, vol.8
, pp. 1047-1062
-
-
Scorciapino, M.A.1
D'Agostino, T.2
Acosta-Gutierrez, S.3
Malloci, G.4
Bodrenko, I.5
Ceccarelli, M.6
-
8
-
-
84941254912
-
A Database of Force-Field Parameters, Dynamics, and Properties of Antimicrobial Compounds
-
Malloci, G.; Vargiu, A. V.; Serra, G.; Bosin, A.; Ruggerone, P.; Ceccarelli, M. A Database of Force-Field Parameters, Dynamics, and Properties of Antimicrobial Compounds Molecules 2015, 20, 13997-14021 10.3390/molecules200813997
-
(2015)
Molecules
, vol.20
, pp. 13997-14021
-
-
Malloci, G.1
Vargiu, A.V.2
Serra, G.3
Bosin, A.4
Ruggerone, P.5
Ceccarelli, M.6
-
9
-
-
0035861454
-
Water Permeation across Biological Membranes: Mechanism and Dynamics of Aquaporin-1 and GlpF
-
de Groot, B. L.; Grubmüller, H. Water Permeation across Biological Membranes: Mechanism and Dynamics of Aquaporin-1 and GlpF Science 2001, 294, 2353-2357 10.1126/science.1062459
-
(2001)
Science
, vol.294
, pp. 2353-2357
-
-
De Groot, B.L.1
Grubmüller, H.2
-
10
-
-
0037134267
-
Control of the Selectivity of the Aquaporin Water Channel Family by Global Orientational Tuning
-
Tajkhorshid, E.; Nollert, P.; Jensen, M. Ø.; Miercke, L. J. W.; O'Connell, J.; Stroud, R. M.; Schulten, K. Control of the Selectivity of the Aquaporin Water Channel Family by Global Orientational Tuning Science 2002, 296, 525-530 10.1126/science.1067778
-
(2002)
Science
, vol.296
, pp. 525-530
-
-
Tajkhorshid, E.1
Nollert, P.2
Jensen, M.Ø.3
Miercke, L.J.W.4
O'Connell, J.5
Stroud, R.M.6
Schulten, K.7
-
11
-
-
84944278239
-
Physical Methods to Quantify Small Antibiotic Molecules Uptake into Gram-Negative Bacteria
-
Winterhalter, M.; Ceccarelli, M. Physical Methods to Quantify Small Antibiotic Molecules Uptake into Gram-Negative Bacteria Eur. J. Pharm. Biopharm. 2015, 95, 63-67 10.1016/j.ejpb.2015.05.006
-
(2015)
Eur. J. Pharm. Biopharm.
, vol.95
, pp. 63-67
-
-
Winterhalter, M.1
Ceccarelli, M.2
-
12
-
-
84938327178
-
ESKAPEing the Labyrinth of Antibacterial Discovery
-
Tommasi, R.; Brown, D. G.; Walkup, G. K.; Manchester, J. I.; Miller, A. A. ESKAPEing the Labyrinth of Antibacterial Discovery Nat. Rev. Drug Discovery 2015, 14, 529-542 10.1038/nrd4572
-
(2015)
Nat. Rev. Drug Discovery
, vol.14
, pp. 529-542
-
-
Tommasi, R.1
Brown, D.G.2
Walkup, G.K.3
Manchester, J.I.4
Miller, A.A.5
-
13
-
-
33845903833
-
Drugs for Bad Bugs: Confronting the Challenges of Antibacterial Discovery
-
Payne, D. J.; Gwynn, M. N.; Holmes, D. J.; Pompliano, D. L. Drugs for Bad Bugs: Confronting the Challenges of Antibacterial Discovery Nat. Rev. Drug Discovery 2007, 6, 29-40 10.1038/nrd2201
-
(2007)
Nat. Rev. Drug Discovery
, vol.6
, pp. 29-40
-
-
Payne, D.J.1
Gwynn, M.N.2
Holmes, D.J.3
Pompliano, D.L.4
-
14
-
-
84899087499
-
TRANSLOCATION Project: How to Get Good Drugs into Bad Bugs
-
Stavenger, R. A.; Winterhalter, M. TRANSLOCATION Project: How to Get Good Drugs into Bad Bugs Sci. Transl. Med. 2014, 6, 228ed7 10.1126/scitranslmed.3008605
-
(2014)
Sci. Transl. Med.
, vol.6
, pp. 228ed7
-
-
Stavenger, R.A.1
Winterhalter, M.2
-
15
-
-
85015214452
-
General Method to Determine the Flux of Charged Molecules through Nanopores Applied to β-Lactamase Inhibitors and OmpF
-
Ghai, I.; Pira, A.; Scorciapino, M. A.; Bodrenko, I.; Benier, L.; Ceccarelli, M.; Winterhalter, M.; Wagner, R. General Method to Determine the Flux of Charged Molecules through Nanopores Applied to β-Lactamase Inhibitors and OmpF J. Phys. Chem. Lett. 2017, 8, 1295-1301 10.1021/acs.jpclett.7b00062
-
(2017)
J. Phys. Chem. Lett.
, vol.8
, pp. 1295-1301
-
-
Ghai, I.1
Pira, A.2
Scorciapino, M.A.3
Bodrenko, I.4
Benier, L.5
Ceccarelli, M.6
Winterhalter, M.7
Wagner, R.8
-
16
-
-
84926648408
-
Thinking Outside the "bug": A Unique Assay to Measure Intracellular Drug Penetration in Gram-Negative Bacteria
-
Zhou, Y.; Joubran, C.; Miller-Vedam, L.; Isabella, V.; Nayar, A.; Tentarelli, S.; Miller, A. Thinking Outside the "Bug": A Unique Assay to Measure Intracellular Drug Penetration in Gram-Negative Bacteria Anal. Chem. 2015, 87, 3579-3584 10.1021/ac504880r
-
(2015)
Anal. Chem.
, vol.87
, pp. 3579-3584
-
-
Zhou, Y.1
Joubran, C.2
Miller-Vedam, L.3
Isabella, V.4
Nayar, A.5
Tentarelli, S.6
Miller, A.7
-
17
-
-
84953432272
-
Quantification of Fluoroquinolone Uptake through the Outer Membrane Channel OmpF of Escherichia coli
-
Cama, J.; Bajaj, H.; Pagliara, S.; Maier, T.; Braun, Y.; Winterhalter, M.; Keyser, U. F. Quantification of Fluoroquinolone Uptake through the Outer Membrane Channel OmpF of Escherichia Coli J. Am. Chem. Soc. 2015, 137, 13836-13843 10.1021/jacs.5b08960
-
(2015)
J. Am. Chem. Soc.
, vol.137
, pp. 13836-13843
-
-
Cama, J.1
Bajaj, H.2
Pagliara, S.3
Maier, T.4
Braun, Y.5
Winterhalter, M.6
Keyser, U.F.7
-
18
-
-
84862234673
-
Antibiotic Transport in Resistant Bacteria: Synchrotron UV Fluorescence Microscopy to Determine Antibiotic Accumulation with Single Cell Resolution
-
Kaščáková, S.; Maigre, L.; Chevalier, J.; Réfrégiers, M.; Pagès, J.-M. Antibiotic Transport in Resistant Bacteria: Synchrotron UV Fluorescence Microscopy to Determine Antibiotic Accumulation with Single Cell Resolution PLoS One 2012, 7, e38624 10.1371/journal.pone.0038624
-
(2012)
PLoS One
, vol.7
, pp. e38624
-
-
Kaščáková, S.1
Maigre, L.2
Chevalier, J.3
Réfrégiers, M.4
Pagès, J.-M.5
-
19
-
-
0026001166
-
A Comparison of Methods Used for Measuring the Accumulation of Quinolones by Enterobacteriaceae, Pseudomonas Aeruginosa and Staphylococcus Aureus
-
Mortimer, P. G.; Piddock, L. J. A Comparison of Methods Used for Measuring the Accumulation of Quinolones by Enterobacteriaceae, Pseudomonas Aeruginosa and Staphylococcus Aureus J. Antimicrob. Chemother. 1991, 28, 639-653 10.1093/jac/28.5.639
-
(1991)
J. Antimicrob. Chemother.
, vol.28
, pp. 639-653
-
-
Mortimer, P.G.1
Piddock, L.J.2
-
20
-
-
84859962388
-
Antibiotic Permeation across the OmpF Channel: Modulation of the Affinity Site in the Presence of Magnesium
-
Raj Singh, P.; Ceccarelli, M.; Lovelle, M.; Winterhalter, M.; Mahendran, K. R. Antibiotic Permeation across the OmpF Channel: Modulation of the Affinity Site in the Presence of Magnesium J. Phys. Chem. B 2012, 116, 4433-4438 10.1021/jp2123136
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 4433-4438
-
-
Raj Singh, P.1
Ceccarelli, M.2
Lovelle, M.3
Winterhalter, M.4
Mahendran, K.R.5
-
21
-
-
84863470343
-
Nanopores: A Journey towards DNA Sequencing
-
Wanunu, M. Nanopores: A Journey towards DNA Sequencing Phys. Life Rev. 2012, 9, 125-158 10.1016/j.plrev.2012.05.010
-
(2012)
Phys. Life Rev.
, vol.9
, pp. 125-158
-
-
Wanunu, M.1
-
22
-
-
84876412824
-
Multistep Protein Unfolding during Nanopore Translocation
-
Rodriguez-Larrea, D.; Bayley, H. Multistep Protein Unfolding during Nanopore Translocation Nat. Nanotechnol. 2013, 8, 288-295 10.1038/nnano.2013.22
-
(2013)
Nat. Nanotechnol.
, vol.8
, pp. 288-295
-
-
Rodriguez-Larrea, D.1
Bayley, H.2
-
23
-
-
84871594645
-
Pulling Peptides across Nanochannels: Resolving Peptide Binding and Translocation through the Hetero-Oligomeric Channel from Nocardia Farcinica
-
Singh, P. R.; Bárcena-Uribarri, I.; Modi, N.; Kleinekathöfer, U.; Benz, R.; Winterhalter, M.; Mahendran, K. R. Pulling Peptides across Nanochannels: Resolving Peptide Binding and Translocation through the Hetero-Oligomeric Channel from Nocardia Farcinica ACS Nano 2012, 6, 10699-10707 10.1021/nn303900y
-
(2012)
ACS Nano
, vol.6
, pp. 10699-10707
-
-
Singh, P.R.1
Bárcena-Uribarri, I.2
Modi, N.3
Kleinekathöfer, U.4
Benz, R.5
Winterhalter, M.6
Mahendran, K.R.7
-
24
-
-
84963756754
-
Role of Electroosmosis in the Permeation of Neutral Molecules: CymA and Cyclodextrin as an Example
-
Bhamidimarri, S. P.; Prajapati, J. D.; van den Berg, B.; Winterhalter, M.; Kleinekathöfer, U. Role of Electroosmosis in the Permeation of Neutral Molecules: CymA and Cyclodextrin as an Example Biophys. J. 2016, 110, 600-611 10.1016/j.bpj.2015.12.027
-
(2016)
Biophys. J.
, vol.110
, pp. 600-611
-
-
Bhamidimarri, S.P.1
Prajapati, J.D.2
Van Den Berg, B.3
Winterhalter, M.4
Kleinekathöfer, U.5
-
25
-
-
67649206290
-
Origin of the Electrophoretic Force on DNA in Solid-State Nanopores
-
van Dorp, S.; Keyser, U. F.; Dekker, N. H.; Dekker, C.; Lemay, S. G. Origin of the Electrophoretic Force on DNA in Solid-State Nanopores Nat. Phys. 2009, 5, 347-351 10.1038/nphys1230
-
(2009)
Nat. Phys.
, vol.5
, pp. 347-351
-
-
Van Dorp, S.1
Keyser, U.F.2
Dekker, N.H.3
Dekker, C.4
Lemay, S.G.5
-
26
-
-
0346734135
-
Electroosmotic Enhancement of the Binding of a Neutral Molecule to a Transmembrane Pore
-
Gu, L.-Q.; Cheley, S.; Bayley, H. Electroosmotic Enhancement of the Binding of a Neutral Molecule to a Transmembrane Pore Proc. Natl. Acad. Sci. U. S. A. 2003, 100, 15498-15503 10.1073/pnas.2531778100
-
(2003)
Proc. Natl. Acad. Sci. U. S. A.
, vol.100
, pp. 15498-15503
-
-
Gu, L.-Q.1
Cheley, S.2
Bayley, H.3
-
27
-
-
33747758697
-
Stochastic Detection of Enantiomers
-
Kang, X.-F.; Cheley, S.; Guan, X.; Bayley, H. Stochastic Detection of Enantiomers J. Am. Chem. Soc. 2006, 128, 10684-10685 10.1021/ja063485l
-
(2006)
J. Am. Chem. Soc.
, vol.128
, pp. 10684-10685
-
-
Kang, X.-F.1
Cheley, S.2
Guan, X.3
Bayley, H.4
-
28
-
-
33646138013
-
Interaction of Zwitterionic Penicillins with the OmpF Channel Facilitates Their Translocation
-
Danelon, C.; Nestorovich, E. M.; Winterhalter, M.; Ceccarelli, M.; Bezrukov, S. M. Interaction of Zwitterionic Penicillins with the OmpF Channel Facilitates Their Translocation Biophys. J. 2006, 90, 1617-1627 10.1529/biophysj.105.075192
-
(2006)
Biophys. J.
, vol.90
, pp. 1617-1627
-
-
Danelon, C.1
Nestorovich, E.M.2
Winterhalter, M.3
Ceccarelli, M.4
Bezrukov, S.M.5
-
29
-
-
84887783480
-
A Structural Study of Ion Permeation in OmpF Porin from Anomalous X-Ray Diffraction and Molecular Dynamics Simulations
-
Dhakshnamoorthy, B.; Ziervogel, B. K.; Blachowicz, L.; Roux, B. A Structural Study of Ion Permeation in OmpF Porin from Anomalous X-Ray Diffraction and Molecular Dynamics Simulations J. Am. Chem. Soc. 2013, 135, 16561-16568 10.1021/ja407783a
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 16561-16568
-
-
Dhakshnamoorthy, B.1
Ziervogel, B.K.2
Blachowicz, L.3
Roux, B.4
-
30
-
-
0347193736
-
Reaction-Rate Theory: Fifty Years after Kramers
-
Hänggi, P.; Borkovec, M.; Talkner, P. Reaction-Rate Theory: Fifty Years after Kramers Rev. Mod. Phys. 1990, 62, 251-341 10.1103/RevModPhys.62.251
-
(1990)
Rev. Mod. Phys.
, vol.62
, pp. 251-341
-
-
Hänggi, P.1
Borkovec, M.2
Talkner, P.3
-
31
-
-
0038637764
-
On Translocation through a Membrane Channel via an Internal Binding Site: Kinetics and Voltage Dependence
-
Schwarz, G.; Danelon, C.; Winterhalter, M. On Translocation through a Membrane Channel via an Internal Binding Site: Kinetics and Voltage Dependence Biophys. J. 2003, 84, 2990-2998 10.1016/S0006-3495(03)70025-3
-
(2003)
Biophys. J.
, vol.84
, pp. 2990-2998
-
-
Schwarz, G.1
Danelon, C.2
Winterhalter, M.3
-
32
-
-
0030218764
-
Current Status of Transition-State Theory
-
Truhlar, D. G.; Garrett, B. C.; Klippenstein, S. J. Current Status of Transition-State Theory J. Phys. Chem. 1996, 100, 12771-12800 10.1021/jp953748q
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 12771-12800
-
-
Truhlar, D.G.1
Garrett, B.C.2
Klippenstein, S.J.3
-
33
-
-
84962077022
-
Macroscopic Electric Field inside Water-Filled Biological Nanopores
-
Gutiérrez, S. A.; Bodrenko, I.; Scorciapino, M. A.; Ceccarelli, M. Macroscopic Electric Field inside Water-Filled Biological Nanopores Phys. Chem. Chem. Phys. 2016, 18, 8855-8864 10.1039/C5CP07902K
-
(2016)
Phys. Chem. Chem. Phys.
, vol.18
, pp. 8855-8864
-
-
Gutiérrez, S.A.1
Bodrenko, I.2
Scorciapino, M.A.3
Ceccarelli, M.4
-
34
-
-
84930227341
-
Filtering with Electric Field: The Case of E. Coli Porins
-
Acosta-Gutierrez, S.; Scorciapino, M. A.; Bodrenko, I.; Ceccarelli, M. Filtering with Electric Field: The Case of E. Coli Porins J. Phys. Chem. Lett. 2015, 6, 1807-1812 10.1021/acs.jpclett.5b00612
-
(2015)
J. Phys. Chem. Lett.
, vol.6
, pp. 1807-1812
-
-
Acosta-Gutierrez, S.1
Scorciapino, M.A.2
Bodrenko, I.3
Ceccarelli, M.4
-
35
-
-
84872140979
-
The Binding of Antibiotics in OmpF Porin
-
Ziervogel, B. K.; Roux, B. The Binding of Antibiotics in OmpF Porin Structure 2013, 21, 76-87 10.1016/j.str.2012.10.014
-
(2013)
Structure
, vol.21
, pp. 76-87
-
-
Ziervogel, B.K.1
Roux, B.2
-
36
-
-
0028000828
-
Electrostatic Properties of Two Porin Channels from Escherichia coli
-
Karshikoff, A.; Spassov, V.; Cowan, S. W.; Ladenstein, R.; Schirmer, T. Electrostatic Properties of Two Porin Channels from Escherichia Coli J. Mol. Biol. 1994, 240, 372-384 10.1006/jmbi.1994.1451
-
(1994)
J. Mol. Biol.
, vol.240
, pp. 372-384
-
-
Karshikoff, A.1
Spassov, V.2
Cowan, S.W.3
Ladenstein, R.4
Schirmer, T.5
-
37
-
-
84887849212
-
Quantitative Imaging of the Electrostatic Field and Potential Generated by a Transmembrane Protein Pore at Subnanometer Resolution
-
Pfreundschuh, M.; Hensen, U.; Müller, D. J. Quantitative Imaging of the Electrostatic Field and Potential Generated by a Transmembrane Protein Pore at Subnanometer Resolution Nano Lett. 2013, 13, 5585-5593 10.1021/nl403232z
-
(2013)
Nano Lett.
, vol.13
, pp. 5585-5593
-
-
Pfreundschuh, M.1
Hensen, U.2
Müller, D.J.3
-
38
-
-
85000949385
-
Electrostatic Deflection of a Molecular Beam of Massive Neutral Particles: Fully Field-Oriented Polar Molecules within Superfluid Nanodroplets
-
Merthe, D. J.; Kresin, V. V. Electrostatic Deflection of a Molecular Beam of Massive Neutral Particles: Fully Field-Oriented Polar Molecules within Superfluid Nanodroplets J. Phys. Chem. Lett. 2016, 7, 4879-4883 10.1021/acs.jpclett.6b02401
-
(2016)
J. Phys. Chem. Lett.
, vol.7
, pp. 4879-4883
-
-
Merthe, D.J.1
Kresin, V.V.2
-
39
-
-
84954513819
-
Nanopore Sensing at Ultra-Low Concentrations Using Single-Molecule Dielectrophoretic Trapping
-
Freedman, K. J.; Otto, L. M.; Ivanov, A. P.; Barik, A.; Oh, S.-H.; Edel, J. B. Nanopore Sensing at Ultra-Low Concentrations Using Single-Molecule Dielectrophoretic Trapping Nat. Commun. 2016, 7, 10217 10.1038/ncomms10217
-
(2016)
Nat. Commun.
, vol.7
, pp. 10217
-
-
Freedman, K.J.1
Otto, L.M.2
Ivanov, A.P.3
Barik, A.4
Oh, S.-H.5
Edel, J.B.6
-
40
-
-
0015459562
-
Formation of Bimolecular Membranes from Lipid Monolayers and a Study of Their Electrical Properties
-
Montal, M.; Mueller, P. Formation of Bimolecular Membranes from Lipid Monolayers and a Study of Their Electrical Properties Proc. Natl. Acad. Sci. U. S. A. 1972, 69, 3561-3566 10.1073/pnas.69.12.3561
-
(1972)
Proc. Natl. Acad. Sci. U. S. A.
, vol.69
, pp. 3561-3566
-
-
Montal, M.1
Mueller, P.2
-
41
-
-
67650099787
-
De. ACEMD: Accelerating Biomolecular Dynamics in the Microsecond Time Scale
-
Harvey, M. J.; Giupponi, G.; Fabritiis, G. De. ACEMD: Accelerating Biomolecular Dynamics in the Microsecond Time Scale J. Chem. Theory Comput. 2009, 5, 1632-1639 10.1021/ct9000685
-
(2009)
J. Chem. Theory Comput.
, vol.5
, pp. 1632-1639
-
-
Harvey, M.J.1
Giupponi, G.2
Fabritiis, G.3
-
42
-
-
77953513118
-
Improved Side-Chain Torsion Potentials for the Amber ff99SB Protein Force Field
-
Lindorff-Larsen, K.; Piana, S.; Palmo, K.; Maragakis, P.; Klepeis, J. L.; Dror, R. O.; Shaw, D. E. Improved Side-Chain Torsion Potentials for the Amber ff99SB Protein Force Field Proteins: Struct., Funct., Genet. 2010, 78, 1950-1958 10.1002/prot.22711
-
(2010)
Proteins: Struct., Funct., Genet.
, vol.78
, pp. 1950-1958
-
-
Lindorff-Larsen, K.1
Piana, S.2
Palmo, K.3
Maragakis, P.4
Klepeis, J.L.5
Dror, R.O.6
Shaw, D.E.7
-
43
-
-
0004016501
-
Comparison of Simple Potential Functions for Simulating Liquid Water
-
Jorgensen, W. L.; Chandrasekhar, J.; Madura, J. D.; Impey, R. W.; Klein, M. L. Comparison of Simple Potential Functions for Simulating Liquid Water J. Chem. Phys. 1983, 79, 926 10.1063/1.445869
-
(1983)
J. Chem. Phys.
, vol.79
, pp. 926
-
-
Jorgensen, W.L.1
Chandrasekhar, J.2
Madura, J.D.3
Impey, R.W.4
Klein, M.L.5
-
44
-
-
2942532422
-
Development and Testing of a General Amber Force Field
-
Wang, J.; Wolf, R. M.; Caldwell, J. W.; Kollman, P. A.; Case, D. A. Development and Testing of a General Amber Force Field J. Comput. Chem. 2004, 25, 1157-1174 10.1002/jcc.20035
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 1157-1174
-
-
Wang, J.1
Wolf, R.M.2
Caldwell, J.W.3
Kollman, P.A.4
Case, D.A.5
|