-
1
-
-
33845280446
-
-
BICHAW 0006-2960, () 10.1021/bi00405a042;, J. Gen. Physiol. JGPLAD 0022-1295 129, 357 (2007). 10.1085/jg200709743
-
A. Radzicka and R. Wolfenden, Biochemistry BICHAW 0006-2960 27, 1664 (1988) 10.1021/bi00405a042; R. Wolfenden, J. Gen. Physiol. JGPLAD 0022-1295 129, 357 (2007). 10.1085/jgp.200709743
-
(1988)
Biochemistry
, vol.27
, pp. 1664
-
-
Radzicka, A.1
Wolfenden, R.2
Wolfenden, R.3
-
2
-
-
0014481138
-
-
NATUAS 0028-0836,. 10.1038/221844a0
-
A. Parsegian, Nature (London) NATUAS 0028-0836 221, 844 (1969). 10.1038/221844a0
-
(1969)
Nature (London)
, vol.221
, pp. 844
-
-
Parsegian, A.1
-
3
-
-
0022670331
-
-
BIOJAU 0006-3495,. 10.1016/S0006-3495(86)83664-5
-
R. F. Flewelling and W. L. Hubbell, Biophys. J. BIOJAU 0006-3495 49, 541 (1986). 10.1016/S0006-3495(86)83664-5
-
(1986)
Biophys. J.
, vol.49
, pp. 541
-
-
Flewelling, R.F.1
Hubbell, W.L.2
-
4
-
-
0031982611
-
-
BIOJAU 0006-3495,. 10.1016/S0006-3495(98)77789-6
-
S. Paula, A. G. Volkov, and D. W. Deamer, Biophys. J. BIOJAU 0006-3495 74, 319 (1998). 10.1016/S0006-3495(98)77789-6
-
(1998)
Biophys. J.
, vol.74
, pp. 319
-
-
Paula, S.1
Volkov, A.G.2
Deamer, D.W.3
-
5
-
-
0031148684
-
Two mechanisms of permeation of small neutral molecules and hydrated ions across phospholipid bilayers
-
DOI 10.1016/S0302-4598(96)05097-0, PII S0302459896050970
-
A. G. Volkov, S. Paula, and D. W. Deamer, Bioelectrochem. Bioenerg. BEBEBP 0302-4598 42, 153 (1997). 10.1016/S0302-4598(96)05097-0 (Pubitemid 27273840)
-
(1997)
Bioelectrochemistry and Bioenergetics
, vol.42
, Issue.2
, pp. 153-160
-
-
Volkov, A.G.1
Paula, S.2
Deamer, D.W.3
-
6
-
-
0036667305
-
-
CHREAY 0009-2665,. 10.1021/cr000692, (Washington, D.C.)
-
L. R. Pratt and A. Pohorille, Chem. Rev. (Washington, D.C.) CHREAY 0009-2665 102, 2671 (2002). 10.1021/cr000692+
-
(2002)
Chem. Rev.
, vol.102
, pp. 2671
-
-
Pratt, L.R.1
Pohorille, A.2
-
7
-
-
0000110909
-
-
in, edited by J. O. M. Bockris and B. E. Conway (Butterworths, London)
-
R. Parsons, in Modern Aspects of Electrochemistry, edited by, J. O. M. Bockris, and, B. E. Conway, (Butterworths, London, 1954), Vol. 1, p. 103.
-
(1954)
Modern Aspects of Electrochemistry
, vol.1
, pp. 103
-
-
Parsons, R.1
-
8
-
-
44049111054
-
-
BEBEBP 0302-4598,. 10.1016/0302-4598(92)80001-W
-
D. Walz and S. R. Caplan, Bioelectrochem. Bioenerg. BEBEBP 0302-4598 28, 5 (1992). 10.1016/0302-4598(92)80001-W
-
(1992)
Bioelectrochem. Bioenerg.
, vol.28
, pp. 5
-
-
Walz, D.1
Caplan, S.R.2
-
11
-
-
0030222447
-
Electrical double layers at the oil/water interface
-
DOI 10.1016/S0079-6816(97)82876-6, PII S007968169600010X
-
A. G. Volkov, D. W. Deamer, D. L. Tanelian, and V. S. Markin, Prog. Surf. Sci. PSSFBP 0079-6816 53, 1 (1996). 10.1016/S0079-6816(97)82876-6 (Pubitemid 126401333)
-
(1996)
Progress in Surface Science
, vol.53
, Issue.1
, pp. 1-134
-
-
Volkov, A.G.1
Deamer, D.W.2
Tanelian, D.L.3
Markin, V.S.4
-
12
-
-
0033889934
-
Electrical properties of free surface of water and aqueous solutions
-
DOI 10.1016/S0001-8686(99)00014-7
-
M. Paluch, Adv. Colloid Interface Sci. ACISB9 0001-8686 84, 27 (2000) 10.1016/S0001-8686(99)00014-7; (Pubitemid 30526522)
-
(2000)
Advances in Colloid and Interface Science
, vol.84
, Issue.1
, pp. 27-45
-
-
Paluch, M.1
-
13
-
-
0002692257
-
-
JECHES 0022-0728, () 10.1016/0022-0728(92)80205-I
-
C. G. Barraclough, P. T. Mctigue, and Y. L. Ng, J. Electroanal. Chem. JECHES 0022-0728 329, 9 (1992) 10.1016/0022-0728(92)80205-I;
-
(1992)
J. Electroanal. Chem.
, vol.329
, pp. 9
-
-
Barraclough, C.G.1
McTigue, P.T.2
Ng, Y.L.3
-
14
-
-
34547853578
-
Revisiting the hexane-water interface via molecular dynamics simulations using nonadditive alkane-water potentials
-
DOI 10.1063/1.2198538
-
S. A. Patel and C. L. Brooks, J. Chem. Phys. JCPSA6 0021-9606 124, 204706 (2006). 10.1063/1.2198538 (Pubitemid 43838638)
-
(2006)
Journal of Chemical Physics
, vol.124
, Issue.20
, pp. 204706
-
-
Patel, S.A.1
Brooks III, C.L.2
-
15
-
-
0003998388
-
-
edited by D. R. Lide (CRC, Boca Raton, FL)
-
CRC Handbook Chemistry and Physics, edited by, D. R. Lide, (CRC, Boca Raton, FL, 2003).
-
(2003)
CRC Handbook Chemistry and Physics
-
-
-
16
-
-
0001186174
-
-
JCPSA6 0021-9606, () 10.1063/1.1701649
-
F. H. Stillinger and A. Ben-Naim, J. Chem. Phys. JCPSA6 0021-9606 47, 4431 (1967) 10.1063/1.1701649;
-
(1967)
J. Chem. Phys.
, vol.47
, pp. 4431
-
-
Stillinger, F.H.1
Ben-Naim, A.2
-
17
-
-
0024673546
-
-
JCPSA6 0021-9606,. 10.1063/1.456536
-
M. A. Wilson, A. Pohorille, and L. R. Pratt, J. Chem. Phys. JCPSA6 0021-9606 90, 5211 (1989). 10.1063/1.456536
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 5211
-
-
Wilson, M.A.1
Pohorille, A.2
Pratt, L.R.3
-
18
-
-
57849157822
-
-
JCPSA6 0021-9606,. 10.1063/1.3027513
-
E. Harder and B. Roux, J. Chem. Phys. JCPSA6 0021-9606 129, 234706 (2008). 10.1063/1.3027513
-
(2008)
J. Chem. Phys.
, vol.129
, pp. 234706
-
-
Harder, E.1
Roux, B.2
-
19
-
-
0001760319
-
-
MOPHAM 0026-8976,. 10.1080/002689797169916
-
V. P. Sokhan and D. J. Tildesley, Mol. Phys. MOPHAM 0026-8976 92, 625 (1997). 10.1080/002689797169916
-
(1997)
Mol. Phys.
, vol.92
, pp. 625
-
-
Sokhan, V.P.1
Tildesley, D.J.2
-
20
-
-
33645724429
-
-
JPCHAX 0022-3654, () 10.1021/j100016a067
-
J. W. Caldwell and P. A. Kollman, J. Phys. Chem. JPCHAX 0022-3654 99, 6208 (1995) 10.1021/j100016a067;
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 6208
-
-
Caldwell, J.W.1
Kollman, P.A.2
-
21
-
-
0034249487
-
-
JPCBFK 1089-5647,. 10.1021/jp0015067
-
H. S. Ashbaugh, J. Phys. Chem. B JPCBFK 1089-5647 104, 7235 (2000). 10.1021/jp0015067
-
(2000)
J. Phys. Chem. B
, vol.104
, pp. 7235
-
-
Ashbaugh, H.S.1
-
22
-
-
1842422919
-
-
JCPSA6 0021-9606,. 10.1063/1.1644536
-
S. Rajamani, T. Ghosh, and S. Garde, J. Chem. Phys. JCPSA6 0021-9606 120, 4457 (2004). 10.1063/1.1644536
-
(2004)
J. Chem. Phys.
, vol.120
, pp. 4457
-
-
Rajamani, S.1
Ghosh, T.2
Garde, S.3
-
23
-
-
50549097744
-
-
JPCBFK 1089-5647,. 10.1021/jp711492h
-
I. Vorobyov, L. B. Li, and T. W. Allen, J. Phys. Chem. B JPCBFK 1089-5647 112, 9588 (2008). 10.1021/jp711492h
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 9588
-
-
Vorobyov, I.1
Li, L.B.2
Allen, T.W.3
-
24
-
-
72249118179
-
-
JACSAT 0002-7863,. 10.1021/ja908142d
-
S. M. Kathmann, I. F. W. Kuo, and C. J. Mundy, J. Am. Chem. Soc. JACSAT 0002-7863 131, 17522 (2009). 10.1021/ja908142d
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 17522
-
-
Kathmann, S.M.1
Kuo, I.F.W.2
Mundy, C.J.3
-
25
-
-
77349106699
-
-
10.1021/jz900268s
-
K. Leung, J. Phys. Chem. Lett. 1, 496 (2010). 10.1021/jz900268s
-
(2010)
J. Phys. Chem. Lett.
, vol.1
, pp. 496
-
-
Leung, K.1
-
26
-
-
33644879448
-
-
JPCBFK 1089-5647,. 10.1021/jp056043p
-
G. Lamoureux and B. Roux, J. Phys. Chem. B JPCBFK 1089-5647 110, 3308 (2006). 10.1021/jp056043p
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 3308
-
-
Lamoureux, G.1
Roux, B.2
-
27
-
-
0023984891
-
-
JCPSA6 0021-9606,. 10.1063/1.453923
-
M. A. Wilson, A. Pohorille, and L. R. Pratt, J. Chem. Phys. JCPSA6 0021-9606 88, 3281 (1988). 10.1063/1.453923
-
(1988)
J. Chem. Phys.
, vol.88
, pp. 3281
-
-
Wilson, M.A.1
Pohorille, A.2
Pratt, L.R.3
-
28
-
-
0040108959
-
-
ELCAAV 0013-4686,. 10.1016/0013-4686(89)85072-8
-
Z. Koczorowski, I. Zagorska, and A. Kalinska, Electrochim. Acta ELCAAV 0013-4686 34, 1857 (1989). 10.1016/0013-4686(89)85072-8
-
(1989)
Electrochim. Acta
, vol.34
, pp. 1857
-
-
Koczorowski, Z.1
Zagorska, I.2
Kalinska, A.3
-
29
-
-
0002307677
-
-
JECHES 0022-0728,. 10.1016/0022-0728(92)80204-H
-
L. I. Krishtalik, N. M. Alpatova, and E. V. Ovsyannikova, J. Electroanal. Chem. JECHES 0022-0728 329, 1 (1992). 10.1016/0022-0728(92)80204-H
-
(1992)
J. Electroanal. Chem.
, vol.329
, pp. 1
-
-
Krishtalik, L.I.1
Alpatova, N.M.2
Ovsyannikova, E.V.3
-
30
-
-
34249936269
-
-
RCBUEY 1066-5285,. 10.1007/s11172-007-0001-8
-
V. I. Parfenyuk, Russ. Chem. Bull. RCBUEY 1066-5285 56, 1 (2007). 10.1007/s11172-007-0001-8
-
(2007)
Russ. Chem. Bull.
, vol.56
, pp. 1
-
-
Parfenyuk, V.I.1
-
31
-
-
0346850017
-
Ion Solvation Thermodynamics from Simulation with a Polarizable Force Field
-
DOI 10.1021/ja037005r
-
A. Grossfield, P. Y. Ren, and J. W. Ponder, J. Am. Chem. Soc. JACSAT 0002-7863 125, 15671 (2003) 10.1021/ja037005r; (Pubitemid 37532213)
-
(2003)
Journal of the American Chemical Society
, vol.125
, Issue.50
, pp. 15671-15682
-
-
Grossfield, A.1
Ren, P.2
Ponder, J.W.3
-
32
-
-
0342933118
-
-
JMBBBO 0022-2631, () 10.1007/BF01944229
-
A. D. Pickar and R. Benz, J. Membr. Biol. JMBBBO 0022-2631 44, 353 (1978) 10.1007/BF01944229;
-
(1978)
J. Membr. Biol.
, vol.44
, pp. 353
-
-
Pickar, A.D.1
Benz, R.2
-
33
-
-
0036104778
-
-
BIOJAU 0006-3495,. 10.1016/S0006-3495(02)75649-X
-
J. Schamberger and R. J. Clarke, Biophys. J. BIOJAU 0006-3495 82, 3081 (2002). 10.1016/S0006-3495(02)75649-X
-
(2002)
Biophys. J.
, vol.82
, pp. 3081
-
-
Schamberger, J.1
Clarke, R.J.2
-
34
-
-
33845486179
-
Using cryo-EM to measure the dipole potential of a lipid membrane
-
DOI 10.1073/pnas.0608714103
-
L. G. Wang, P. S. Bose, and F. J. Sigworth, Proc. Natl. Acad. Sci. U.S.A. PNASA6 0027-8424 103, 18528 (2006). 10.1073/pnas.0608714103 (Pubitemid 44913444)
-
(2006)
Proceedings of the National Academy of Sciences of the United States of America
, vol.103
, Issue.49
, pp. 18528-18533
-
-
Wang, L.1
Bose, P.S.2
Sigworth, F.J.3
-
35
-
-
0034746677
-
Dipole potential of phospholipid membranes and methods for its detection
-
DOI 10.1016/S0001-8686(00)00061-0
-
R. J. Clarke, Adv. Colloid Interface Sci. ACISB9 0001-8686 89-90, 263 (2001). 10.1016/S0001-8686(00)00061-0 (Pubitemid 32092488)
-
(2001)
Advances in Colloid and Interface Science
, vol.89-90
, pp. 263-281
-
-
Clarke, R.J.1
-
36
-
-
58149355794
-
-
BIOJAU 0006-3495,. 10.1529/biophysj.108.136507
-
Y. Yang, K. M. Mayer, N. S. Wickremasinghe, and J. H. Hafner, Biophys. J. BIOJAU 0006-3495 95, 5193 (2008). 10.1529/biophysj.108.136507
-
(2008)
Biophys. J.
, vol.95
, pp. 5193
-
-
Yang, Y.1
Mayer, K.M.2
Wickremasinghe, N.S.3
Hafner, J.H.4
-
38
-
-
5244326635
-
-
JCCHDD 0192-8651, () 10.1002/(SICI)1096-987X(19990415)20:5<531::AID- JCC5>3.0.CO;2-3;, Biophys. J. BIOJAU 0006-3495 81, 3005 (2001) 10.1016/S0006-3495(01)75941-3;, Langmuir LANGD5 0743-7463 20, 7844 (2004) 10.1021/la049485l;, J. Chem. Phys. JCPSA6 0021-9606 121, 9648 (2004). 10.1063/1.1806791
-
A. M. Smondyrev and M. L. Berkowitz, J. Comput. Chem. JCCHDD 0192-8651 20, 531 (1999) 10.1002/(SICI)1096-987X(19990415)20:5<531::AID-JCC5>3.0. CO;2-3; R. J. Mashl, H. L. Scott, S. Subramaniam, and E. Jakobsson, Biophys. J. BIOJAU 0006-3495 81, 3005 (2001) 10.1016/S0006-3495(01)75941-3; M. A. Villarreal, S. B. Diaz, E. A. Disalvo, and G. G. Montich, Langmuir LANGD5 0743-7463 20, 7844 (2004) 10.1021/la049485l; K. Shinoda, W. Shinoda, T. Baba, and M. Mikami, J. Chem. Phys. JCPSA6 0021-9606 121, 9648 (2004). 10.1063/1.1806791
-
(1999)
J. Comput. Chem.
, vol.20
, pp. 531
-
-
Smondyrev, A.M.1
Berkowitz, M.L.2
Mashl, R.J.3
Scott, H.L.4
Subramaniam, S.5
Jakobsson, E.6
Villarreal, M.A.7
Diaz, S.B.8
Disalvo, E.A.9
Montich, G.G.10
Shinoda, K.11
Shinoda, W.12
Baba, T.13
Mikami, M.14
-
39
-
-
45849126131
-
-
(Elsevier, New York), Vol.,. 10.1016/S1063-5823(08)00001-X
-
J. B. Klauda, R. M. Venable, A. D. MacKerell, and R. W. Pastor, Computational Modeling Of Membrane Bilayers (Elsevier, New York, 2008), Vol. 60, p. 1. 10.1016/S1063-5823(08)00001-X
-
(2008)
Computational Modeling of Membrane Bilayers
, vol.60
, pp. 1
-
-
Klauda, J.B.1
Venable, R.M.2
MacKerell, A.D.3
Pastor, R.W.4
-
40
-
-
67650079292
-
-
JPCBFK 1089-5647,. 10.1021/jp901088g
-
J. E. Davis and S. Patel, J. Phys. Chem. B JPCBFK 1089-5647 113, 9183 (2009). 10.1021/jp901088g
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 9183
-
-
Davis, J.E.1
Patel, S.2
-
41
-
-
58849129143
-
-
BIOJAU 0006-3495,. 10.1016/j.bpj.2008.09.048
-
J. E. Davis, O. Rahaman, and S. Patel, Biophys. J. BIOJAU 0006-3495 96, 385 (2009). 10.1016/j.bpj.2008.09.048
-
(2009)
Biophys. J.
, vol.96
, pp. 385
-
-
Davis, J.E.1
Rahaman, O.2
Patel, S.3
-
42
-
-
84986512474
-
-
JCCHDD 0192-8651, () 10.1002/jcc.540040211
-
B. R. Brooks, R. E. Bruccoleri, B. D. Olafson, D. J. States, S. Swaminathan, and M. Karplus, J. Comput. Chem. JCCHDD 0192-8651 4, 187 (1983) 10.1002/jcc.540040211;
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 187
-
-
Brooks, B.R.1
Bruccoleri, R.E.2
Olafson, B.D.3
States, D.J.4
Swaminathan, S.5
Karplus, M.6
-
43
-
-
0029878720
-
VMD: Visual molecular dynamics
-
DOI 10.1016/0263-7855(96)00018-5
-
W. Humphrey, A. Dalke, and K. Schulten, J. Mol. Graph. 14, 33 (1996). 10.1016/0263-7855(96)00018-5 0263-7855 (Pubitemid 26152973)
-
(1996)
Journal of Molecular Graphics
, vol.14
, Issue.1
, pp. 33-38
-
-
Humphrey, W.1
Dalke, A.2
Schulten, K.3
-
44
-
-
77952736575
-
-
See supplementary material at E-JCPSA6-132-019016 for detailed simulation methods and additional tables and figures.
-
See supplementary material at http://dx.doi.org/10.1063/1.3402125 E-JCPSA6-132-019016 for detailed simulation methods and additional tables and figures.
-
-
-
-
45
-
-
0000999989
-
-
JCCHDD 0192-8651,. 10.1002/(SICI)1096-987X(199802)19:3<334::AID- JCC7>3.0.CO;2-U
-
D. X. Yin and A. D. Mackerell, J. Comput. Chem. JCCHDD 0192-8651 19, 334 (1998). 10.1002/(SICI)1096-987X(199802)19:3<334::AID-JCC7>3.0.CO;2-U
-
(1998)
J. Comput. Chem.
, vol.19
, pp. 334
-
-
Yin, D.X.1
MacKerell, A.D.2
-
46
-
-
0034250744
-
-
JPCBFK 1089-5647,. 10.1021/jp0007843
-
S. E. Feller and A. D. MacKerell, J. Phys. Chem. B JPCBFK 1089-5647 104, 7510 (2000). 10.1021/jp0007843
-
(2000)
J. Phys. Chem. B
, vol.104
, pp. 7510
-
-
Feller, S.E.1
MacKerell, A.D.2
-
47
-
-
36148946078
-
-
JCTCCE 1549-9618,. 10.1021/ct600350s
-
I. Vorobyov, V. M. Anisimov, S. Greene, R. M. Venable, A. Moser, R. W. Pastor, and A. D. MacKerell, J. Chem. Theory Comput. JCTCCE 1549-9618 3, 1120 (2007). 10.1021/ct600350s
-
(2007)
J. Chem. Theory Comput.
, vol.3
, pp. 1120
-
-
Vorobyov, I.1
Anisimov, V.M.2
Greene, S.3
Venable, R.M.4
Moser, A.5
Pastor, R.W.6
MacKerell, A.D.7
-
48
-
-
15744368593
-
An ab initio study on the torsional surface of alkanes and its effect on molecular simulations of alkanes and a DPPC bilayer
-
DOI 10.1021/jp0468096
-
J. B. Klauda, B. R. Brooks, A. D. MacKerell, Jr., R. M. Venable, and R. W. Pastor, J. Phys. Chem. B JPCBFK 1089-5647 109, 5300 (2005). 10.1021/jp0468096 (Pubitemid 40407752)
-
(2005)
Journal of Physical Chemistry B
, vol.109
, Issue.11
, pp. 5300-5311
-
-
Klauda, J.B.1
Brooks, B.R.2
MacKerell Jr., A.D.3
Venable, R.M.4
Pastor, R.W.5
-
49
-
-
0041784950
-
-
JPCBFK 1089-5647,. 10.1021/jp973084f
-
A. D. MacKerell, D. Bashford, M. Bellott, R. L. Dunbrack, J. D. Evanseck, M. J. Field, S. Fischer, J. Gao, H. Guo, S. Ha, D. Joseph-McCarthy, L. Kuchnir, K. Kuczera, F. T. K. Lau, C. Mattos, S. Michnick, T. Ngo, D. T. Nguyen, B. Prodhom, W. E. Reiher, B. Roux, M. Schlenkrich, J. C. Smith, R. Stote, J. Straub, M. Watanabe, J. Wiorkiewicz-Kuczera, D. Yin, and M. Karplus, J. Phys. Chem. B JPCBFK 1089-5647 102, 3586 (1998). 10.1021/jp973084f
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 3586
-
-
MacKerell, A.D.1
Bashford, D.2
Bellott, M.3
Dunbrack, R.L.4
Evanseck, J.D.5
Field, M.J.6
Fischer, S.7
Gao, J.8
Guo, H.9
Ha, S.10
Joseph-Mccarthy, D.11
Kuchnir, L.12
Kuczera, K.13
Lau, F.T.K.14
Mattos, C.15
Michnick, S.16
Ngo, T.17
Nguyen, D.T.18
Prodhom, B.19
Reiher, W.E.20
Roux, B.21
Schlenkrich, M.22
Smith, J.C.23
Stote, R.24
Straub, J.25
Watanabe, M.26
Wiorkiewicz-Kuczera, J.27
Yin, D.28
Karplus, M.29
more..
-
50
-
-
0004016501
-
-
JCPSA6 0021-9606,. 10.1063/1.445869
-
W. L. Jorgensen, J. Chandrasekhar, J. D. Madura, R. W. Impey, and M. L. Klein, J. Chem. Phys. JCPSA6 0021-9606 79, 926 (1983). 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
-
51
-
-
0001655657
-
-
JCPSA6 0021-9606,. 10.1063/1.466711
-
D. Beglov and B. Roux, J. Chem. Phys. JCPSA6 0021-9606 100, 9050 (1994). 10.1063/1.466711
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 9050
-
-
Beglov, D.1
Roux, B.2
-
52
-
-
18744402303
-
-
JCTCCE 1549-9618, () 10.1021/ct049930p
-
V. M. Anisimov, G. Lamoureux, I. V. Vorobyov, N. Huang, B. Roux, and A. D. MacKerell, J. Chem. Theory Comput. JCTCCE 1549-9618 1, 153 (2005) 10.1021/ct049930p;
-
(2005)
J. Chem. Theory Comput.
, vol.1
, pp. 153
-
-
Anisimov, V.M.1
Lamoureux, G.2
Vorobyov, I.V.3
Huang, N.4
Roux, B.5
MacKerell, A.D.6
-
53
-
-
27144489989
-
Polarizable empirical force field for alkanes based on the classical Drude oscillator model
-
DOI 10.1021/jp053182y
-
I. V. Vorobyov, V. M. Anisimov, and A. D. MacKerell, J. Phys. Chem. B JPCBFK 1089-5647 109, 18988 (2005). 10.1021/jp053182y (Pubitemid 41509189)
-
(2005)
Journal of Physical Chemistry B
, vol.109
, Issue.40
, pp. 18988-18999
-
-
Vorobyov, I.V.1
Anisimov, V.M.2
MacKerell Jr., A.D.3
-
54
-
-
30344482264
-
A polarizable model of water for molecular dynamics simulations of biomolecules
-
DOI 10.1016/j.cplett.2005.10.135, PII S0009261405017069
-
G. Lamoureux, E. Harder, I. V. Vorobyov, B. Roux, and A. D. MacKerell, Chem. Phys. Lett. CHPLBC 0009-2614 418, 245 (2006). 10.1016/j.cplett.2005.10.135 (Pubitemid 43063383)
-
(2006)
Chemical Physics Letters
, vol.418
, Issue.1-3
, pp. 245-249
-
-
Lamoureux, G.1
Harder, E.2
Vorobyov, I.V.3
Roux, B.4
MacKerell Jr., A.D.5
-
55
-
-
7044239742
-
-
CHREAY 0009-2665, 10.1021/cr00023a004
-
P. Kollman, Chem. Rev. CHREAY 0009-2665 93, 2395 (1993) 10.1021/cr00023a004.
-
(1993)
Chem. Rev.
, vol.93
, pp. 2395
-
-
Kollman, P.1
-
56
-
-
7544232432
-
-
JPCBFK 1089-5647,. 10.1021/jp048502c
-
Y. Q. Deng and B. Roux, J. Phys. Chem. B JPCBFK 1089-5647 108, 16567 (2004). 10.1021/jp048502c
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 16567
-
-
Deng, Y.Q.1
Roux, B.2
-
57
-
-
0028677654
-
-
JACSAT 0002-7863,. 10.1021/ja00083a038
-
M. A. Wilson and A. Pohorille, J. Am. Chem. Soc. JACSAT 0002-7863 116, 1490 (1994). 10.1021/ja00083a038
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 1490
-
-
Wilson, M.A.1
Pohorille, A.2
-
59
-
-
0000558216
-
-
JCOMEL 0953-8984,. 10.1088/0953-8984/3/42/010
-
B. Yang, D. E. Sullivan, B. Tjiptomargo, and C. G. Gray, J. Phys.: Condens. Matter JCOMEL 0953-8984 3, F109 (1991). 10.1088/0953-8984/3/42/010
-
(1991)
J. Phys.: Condens. Matter
, vol.3
, pp. 109
-
-
Yang, B.1
Sullivan, D.E.2
Tjiptomargo, B.3
Gray, C.G.4
-
60
-
-
36649025074
-
-
PPCPFQ 1463-9076,. 10.1039/b706153f
-
B. A. Pethica, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 9, 6253 (2007). 10.1039/b706153f
-
(2007)
Phys. Chem. Chem. Phys.
, vol.9
, pp. 6253
-
-
Pethica, B.A.1
-
61
-
-
22244445788
-
Imaging α-hemolysin with molecular dynamics: Ionic conductance, osmotic permeability, and the electrostatic potential map
-
DOI 10.1529/biophysj.104.058727
-
A. Aksimentiev and K. Schulten, Biophys. J. BIOJAU 0006-3495 88, 3745 (2005). 10.1529/biophysj.104.058727 (Pubitemid 40991090)
-
(2005)
Biophysical Journal
, vol.88
, Issue.6
, pp. 3745-3761
-
-
Aksimentiev, A.1
Schulten, K.2
-
62
-
-
34250928962
-
-
ZEPYAA 0044-3328,. 10.1007/BF01881023
-
M. Born, Z. Phys. ZEPYAA 0044-3328 1, 45 (1920). 10.1007/BF01881023
-
(1920)
Z. Phys.
, vol.1
, pp. 45
-
-
Born, M.1
-
63
-
-
1542356431
-
-
JPCHAX 0022-3654,. 10.1021/jp960488j
-
J. B. Foresman, T. A. Keith, K. B. Wiberg, J. Snoonian, and M. J. Frisch, J. Phys. Chem. JPCHAX 0022-3654 100, 16098 (1996). 10.1021/jp960488j
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 16098
-
-
Foresman, J.B.1
Keith, T.A.2
Wiberg, K.B.3
Snoonian, J.4
Frisch, M.J.5
-
64
-
-
0000512620
-
-
JPCHAX 0022-3654,. 10.1021/j100339a026
-
I. E. Craven, M. R. Hesling, D. R. Laver, P. B. Lukins, G. L. D. Ritchie, and J. Vrbancich, J. Phys. Chem. JPCHAX 0022-3654 93, 627 (1989). 10.1021/j100339a026
-
(1989)
J. Phys. Chem.
, vol.93
, pp. 627
-
-
Craven, I.E.1
Hesling, M.R.2
Laver, D.R.3
Lukins, P.B.4
Ritchie, G.L.D.5
Vrbancich, J.6
-
65
-
-
38449120033
-
Solvent reaction field potential inside an uncharged globular protein: A bridge between implicit and explicit solvent models?
-
DOI 10.1063/1.2771171
-
D. S. Cerutti, N. A. Baker, and J. A. McCammon, J. Chem. Phys. JCPSA6 0021-9606 127, 155101 (2007) 10.1063/1.2771171; (Pubitemid 351260821)
-
(2007)
Journal of Chemical Physics
, vol.127
, Issue.15
, pp. 155101
-
-
Cerutti, D.S.1
Baker, N.A.2
McCammon, J.A.3
-
66
-
-
57549115581
-
-
JACSAT 0002-7863,. 10.1021/ja802851w
-
S. M. Kathmann, I. F. W. Kuo, and C. J. Mundy, J. Am. Chem. Soc. JACSAT 0002-7863 130, 16556 (2008). 10.1021/ja802851w
-
(2008)
J. Am. Chem. Soc.
, vol.130
, pp. 16556
-
-
Kathmann, S.M.1
Kuo, I.F.W.2
Mundy, C.J.3
-
67
-
-
0026425837
-
-
JCPSA6 0021-9606, () 10.1063/1.461592
-
M. A. Wilson and A. Pohorille, J. Chem. Phys. JCPSA6 0021-9606 95, 6005 (1991) 10.1063/1.461592;
-
(1991)
J. Chem. Phys.
, vol.95
, pp. 6005
-
-
Wilson, M.A.1
Pohorille, A.2
-
68
-
-
67849105001
-
-
JACSAT 0002-7863,. 10.1021/ja8081704
-
I. V. Khavrutskii, A. A. Gorfe, B. Z. Lu, and J. A. McCammon, J. Am. Chem. Soc. JACSAT 0002-7863 131, 1706 (2009). 10.1021/ja8081704
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 1706
-
-
Khavrutskii, I.V.1
Gorfe, A.A.2
Lu, B.Z.3
McCammon, J.A.4
-
69
-
-
77953589882
-
The electrostatics of deformable lipid membranes
-
BIOJAU 0006-3495 (in press)
-
I. V. Vorobyov, B. Bekker, and T. W. Allen, " The electrostatics of deformable lipid membranes.," Biophys. J. BIOJAU 0006-3495 (in press).
-
Biophys. J.
-
-
Vorobyov, I.V.1
Bekker, B.2
Allen, T.W.3
-
70
-
-
77950865843
-
-
JACSAT 0002-7863,. 10.1021/ja806825g
-
E. Harder, A. D. MacKerell, and B. Roux, J. Am. Chem. Soc. JACSAT 0002-7863 131, 2760 (2009). 10.1021/ja806825g
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 2760
-
-
Harder, E.1
MacKerell, A.D.2
Roux, B.3
-
71
-
-
41549149586
-
Biomolecular simulations of membranes: Physical properties from different force fields
-
DOI 10.1063/1.2897760
-
S. W. I. Siu, R. Vacha, P. Jungwirth, and R. A. Bockmann, J. Chem. Phys. JCPSA6 0021-9606 128, 125103 (2008). 10.1063/1.2897760 (Pubitemid 351474132)
-
(2008)
Journal of Chemical Physics
, vol.128
, Issue.12
, pp. 125103
-
-
Siu, S.W.I.1
Vacha, R.2
Jungwirth, P.3
Bockmann, R.A.4
-
73
-
-
53549100466
-
-
JPCCCK 1932-7447,. 10.1021/jp712136e
-
G. L. Warren and S. Patel, J. Phys. Chem. C JPCCCK 1932-7447 112, 7455 (2008). 10.1021/jp712136e
-
(2008)
J. Phys. Chem. C
, vol.112
, pp. 7455
-
-
Warren, G.L.1
Patel, S.2
-
74
-
-
50549085702
-
-
JPCBFK 1089-5647, () 10.1021/jp7114912;
-
L. B. Li, I. Vorobyov, and T. W. Allen, J. Phys. Chem. B JPCBFK 1089-5647 112, 9574 (2008) 10.1021/jp7114912;
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 9574
-
-
Li, L.B.1
Vorobyov, I.2
Allen, T.W.3
|