-
3
-
-
33746271105
-
-
W. F. van Gunsteren, D. Bakowies, R. Baron, I. Chandrasekhar, M. Christen, X. Daura, P. Gee, D. P. Geerke, A. Glattli, P. H. Hunenberger, M. A. Kastenholz, C. Ostenbrink, M. Schenk, D. Trzesniak, N. F. A. van der Vegt, and H. B. Yu, Angew. Chem., Int. Ed. 45, 4064 (2006).
-
(2006)
Angew. Chem., Int. Ed.
, vol.45
, pp. 4064
-
-
Van Gunsteren, W.F.1
Bakowies, D.2
Baron, R.3
Chandrasekhar, I.4
Christen, M.5
Daura, X.6
Gee, P.7
Geerke, D.P.8
Glattli, A.9
Hunenberger, P.H.10
Kastenholz, M.A.11
Ostenbrink, C.12
Schenk, M.13
Trzesniak, D.14
Van Der Vegt, N.F.A.15
Yu, H.B.16
-
8
-
-
25444481354
-
-
P. Liu, B. Kim, R. A. Friesner, and B. J. Berne, Proc. Natl. Acad. Sci. U.S.A. 102, 13749 (2005).
-
(2005)
Proc. Natl. Acad. Sci. U.S.A.
, vol.102
, pp. 13749
-
-
Liu, P.1
Kim, B.2
Friesner, R.A.3
Berne, B.J.4
-
10
-
-
18544381108
-
-
X. Cheng, G. Cui, V. Hornak, and C. Simmerling, J. Phys. Chem. B 109, 8220 (2005).
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 8220
-
-
Cheng, X.1
Cui, G.2
Hornak, V.3
Simmerling, C.4
-
12
-
-
33750035856
-
-
A. Okur, L. Wickstrom, M. Layten, R. Geney, K. Song, V. Hornak, and C. Simmerling, J. Chem. Theory Comput. 2, 420 (2006).
-
(2006)
J. Chem. Theory Comput.
, vol.2
, pp. 420
-
-
Okur, A.1
Wickstrom, L.2
Layten, M.3
Geney, R.4
Song, K.5
Hornak, V.6
Simmerling, C.7
-
13
-
-
4043171970
-
-
D. Qiu, P. S. Shenkin, F. P. Hollinger, and W. C. Still, J. Phys. Chem. A 101, 3005 (1997).
-
(1997)
J. Phys. Chem. A
, vol.101
, pp. 3005
-
-
Qiu, D.1
Shenkin, P.S.2
Hollinger, F.P.3
Still, W.C.4
-
15
-
-
4143145167
-
-
S. Honda, K. Yamasaki, Y. Sawada, and H. Morii, Structure (London) 12, 1507 (2004).
-
(2004)
Structure (London)
, vol.12
, pp. 1507
-
-
Honda, S.1
Yamasaki, K.2
Sawada, Y.3
Morii, H.4
-
18
-
-
0000388705
-
-
B. Hess, H. Bekker, H. J. C. Berendsen, and J. G. E. M. Fraaije, J. Comput. Chem. 18, 1463 (1997).
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 1463
-
-
Hess, B.1
Bekker, H.2
Berendsen, H.J.C.3
Fraaije, J.G.E.M.4
-
20
-
-
0037080244
-
-
W. Rocchia, S. Sridharan, A. Nicholls, E. Alexov, A. Chiabrera, and B. Honig, J. Comput. Chem. 23, 128 (2002).
-
(2002)
J. Comput. Chem.
, vol.23
, pp. 128
-
-
Rocchia, W.1
Sridharan, S.2
Nicholls, A.3
Alexov, E.4
Chiabrera, A.5
Honig, B.6
-
21
-
-
0000304948
-
-
D. J. Tannor, B. Marten, R. Murphy, R. A. Richard, A. Friesner, D. Sitkoff, A. Nicholls, M. Ringnalda, W. A. Goddard III, and B. Barry Honig, J. Am. Chem. Soc. 116, 11875 (1994).
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 11875
-
-
Tannor, D.J.1
Marten, B.2
Murphy, R.3
Richard, R.A.4
Friesner, A.5
Sitkoff, D.6
Nicholls, A.7
Ringnalda, M.8
Iii, A.G.W.9
Barry Honig, B.10
-
22
-
-
27344454932
-
-
D. van der Spoel, E. Lindahl, B. Hess, G. Groenhof, A. E. Mark, and H. J. Berendsen, J. Comput. Chem. 26, 1701 (2005).
-
(2005)
J. Comput. Chem.
, vol.26
, pp. 1701
-
-
Van Der Spoel, D.1
Lindahl, E.2
Hess, B.3
Groenhof, G.4
Mark, A.E.5
Berendsen, H.J.6
-
24
-
-
0033556236
-
-
X. Daura, K. Gademann, B. Jaun, D. Seebach, W. F. van Gunsteren, and A. E. Mark, Angew. Chem., Int. Ed. 38, 236 (1999).
-
(1999)
Angew. Chem., Int. Ed.
, vol.38
, pp. 236
-
-
Daura, X.1
Gademann, K.2
Jaun, B.3
Seebach, D.4
Van Gunsteren, W.F.5
Mark, A.E.6
-
32
-
-
1642570290
-
-
C. D. Snow, L. Qiu, D. Du, F. Gai, S. J. Hagen, and V. S. Pande, Proc. Natl. Acad. Sci. U.S.A. 101, 4077 (2004).
-
(2004)
Proc. Natl. Acad. Sci. U.S.A.
, vol.101
, pp. 4077
-
-
Snow, C.D.1
Qiu, L.2
Du, D.3
Gai, F.4
Hagen, S.J.5
Pande, V.S.6
-
33
-
-
28644431872
-
-
P. H. Nguyen, G. Stock, E. Mittag, C. K. Hu, M. S. Li, Proteins 61, 795 (2005).
-
(2005)
Proteins
, vol.61
, pp. 795
-
-
Nguyen, P.H.1
Stock, G.2
Mittag, E.3
Hu, C.K.4
Li, M.S.5
-
36
-
-
0032568537
-
-
V. Munoz, E. R. Henry, J. Hofrichter, and W. A. Eaton, Proc. Natl. Acad. Sci. U.S.A. 95, 5872 (1998).
-
(1998)
Proc. Natl. Acad. Sci. U.S.A.
, vol.95
, pp. 5872
-
-
Munoz, V.1
Henry, E.R.2
Hofrichter, J.3
Eaton, W.A.4
-
37
-
-
43149108552
-
-
V. Munoz, P. A. Thompson, J. Hofrichter, and W. A. Eaton, Nature (London) 390, 196 (2003).
-
(2003)
Nature (London)
, vol.390
, pp. 196
-
-
Munoz, V.1
Thompson, P.A.2
Hofrichter, J.3
Eaton, W.A.4
-
42
-
-
34247339716
-
-
F. Noe, I. Horenko, C. Schutte, and J. C. Smith, J. Chem. Phys. 126, 155102 (2007).
-
(2007)
J. Chem. Phys.
, vol.126
, pp. 155102
-
-
Noe, F.1
Horenko, I.2
Schutte, C.3
Smith, J.C.4
-
43
-
-
0242663237
-
-
Y. Duan, C. Wu, S. Chowdhury, M. C. Lee, G. Xiong, W. Zhang, R. Yang, P. Cieplak, R. Luo, T. Lee, J. Caldwell, J. Wang, and P. Kollman, J. Comput. Chem. 24, 1999 (2003).
-
(2003)
J. Comput. Chem.
, vol.24
, pp. 1999
-
-
Duan, Y.1
Wu, C.2
Chowdhury, S.3
Lee, M.C.4
Xiong, G.5
Zhang, W.6
Yang, R.7
Cieplak, P.8
Luo, R.9
Lee, T.10
Caldwell, J.11
Wang, J.12
Kollman, P.13
-
46
-
-
18744366086
-
-
M. Andrec, A. K. Felts, E. Gallicchio, and R. M. Levy, Proc. Natl. Acad. Sci. U.S.A. 102, 6801 (2005).
-
(2005)
Proc. Natl. Acad. Sci. U.S.A.
, vol.102
, pp. 6801
-
-
Andrec, M.1
Felts, A.K.2
Gallicchio, E.3
Levy, R.M.4
-
47
-
-
34548273698
-
-
S. Yang, J. N. Onuchic, A. E. Garcia, and H. Levine, J. Mol. Biol. 372, 756 (2007).
-
(2007)
J. Mol. Biol.
, vol.372
, pp. 756
-
-
Yang, S.1
Onuchic, J.N.2
Garcia, A.E.3
Levine, H.4
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