-
3
-
-
0036107171
-
-
Eddleston, M.; Szinicz, L.; Eyer P.; Buckley, N.; QJM-Ass. Int. J. Med. 2002, 95, 275.
-
(2002)
QJM-Ass. Int. J. Med.
, vol.95
, pp. 275
-
-
Eddleston, M.1
Szinicz, L.2
Eyer, P.3
Buckley, N.4
-
5
-
-
27744534918
-
-
da Silva, G.R.; Júnior, I.B.; Figueroa-Villar, J.D.; Int. J. Quant. Chem. 2005, 105, 260.
-
(2005)
Int. J. Quant. Chem.
, vol.105
, pp. 260
-
-
Da Silva, G.R.1
Júnior, I.B.2
Figueroa-Villar, J.D.3
-
6
-
-
12944255678
-
-
Kryger, G.; Harel, M.; Giles, K.; Toker, L.; Velan, B.; Lazar, A.; Kronman, C.; Barak, D.; Ariel, N.; Shafferman, A.; Silman, I.; Sussman, J. L.; Acta Crystallogr. 2000, 56, 1385.
-
(2000)
Acta Crystallogr.
, vol.56
, pp. 1385
-
-
Kryger, G.1
Harel, M.2
Giles, K.3
Toker, L.4
Velan, B.5
Lazar, A.6
Kronman, C.7
Barak, D.8
Ariel, N.9
Shafferman, A.10
Silman, I.11
Sussman, J.L.12
-
8
-
-
0042622380
-
-
Schwede, T.; Kopp, J.; Guex, N.; Peitsch, M. C.; Nucl. Ac. Res. 2003, 31, 3381.
-
(2003)
Nucl. Ac. Res.
, vol.31
, pp. 3381
-
-
Schwede, T.1
Kopp, J.2
Guex, N.3
Peitsch, M.C.4
-
10
-
-
0029633168
-
-
Berendsen, H. J. C.; van der Spoel, D.; van Drunen, R.; Comp. Phys. Comm. 1995, 91, 43.
-
(1995)
Comp. Phys. Comm.
, vol.91
, pp. 43
-
-
Berendsen, H.J.C.1
Van Der Spoel, D.2
Van Drunen, R.3
-
11
-
-
0035789518
-
-
Lindahl, E.; Hess, B.; van der Spoel, D. J.; Mol. Mod. 2001, 7, 306.
-
(2001)
Mol. Mod.
, vol.7
, pp. 306
-
-
Lindahl, E.1
Hess, B.2
Van Der Spoel, D.J.3
-
12
-
-
85039246830
-
-
accessed in August 2004
-
http://biotech.ebi.ac.uk:8400/, accessed in August 2004.
-
-
-
-
14
-
-
0003916606
-
-
Groningen, The Netherlands
-
van der Spoel, D.; van Buuren, A. R.; Apol, E.; Meulenhoff, P. J.; Tieleman, D. P.; Sijbers, A. L. T. M.; Hess, B.; Feenstra, K. A.; Lindahl, E.; van Drunen, R.; Berendsen, H. J. C.; Gromacs User Manual, version 3.1.1, Groningen, The Netherlands, 2002.
-
(2002)
Gromacs User Manual, Version 3.1.1
-
-
Van Der Spoel, D.1
Van Buuren, A.R.2
Apol, E.3
Meulenhoff, P.J.4
Tieleman, D.P.5
Sijbers, A.L.T.M.6
Hess, B.7
Feenstra, K.A.8
Lindahl, E.9
Van Drunen, R.10
Berendsen, H.J.C.11
-
15
-
-
84893169025
-
-
Schmidt, M. W.; Baldridge, K. K.; Boatz, J. A.; Elbert, S. T.; Gordon, M. S.; Jensen, J. H.; Koseki, S.; Matsunaga, N.; Nguyen, K. A.; Su, S. J.; Windus, T. L.; Dupuis, M.; Montgomery, J. A.; J. Comput. Chem. 1993, 14, 1347.
-
(1993)
J. Comput. Chem.
, vol.14
, pp. 1347
-
-
Schmidt, M.W.1
Baldridge, K.K.2
Boatz, J.A.3
Elbert, S.T.4
Gordon, M.S.5
Jensen, J.H.6
Koseki, S.7
Matsunaga, N.8
Nguyen, K.A.9
Su, S.J.10
Windus, T.L.11
Dupuis, M.12
Montgomery, J.A.13
-
16
-
-
33846823909
-
-
Darden, T.; York, D.; Pedersen, L.; J. Chem. Phys. 1993, 98, 10089.
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 10089
-
-
Darden, T.1
York, D.2
Pedersen, L.3
-
17
-
-
33645961739
-
-
Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pedersen, L. G.; J. Chem. Phys. 1995, 103, 8577.
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pedersen, L.G.6
-
18
-
-
33749570054
-
-
Washington University in St. Louis Department of Biochemistry and Molecular Biophysics Center for Computational Biology, Washington University, St. Louis
-
Baker, N. A.; APBS 0.3.2 User Guide. Adaptive Poisson-Boltzmann Solver, Washington University in St. Louis Department of Biochemistry and Molecular Biophysics Center for Computational Biology, Washington University, St. Louis, 2004.
-
(2004)
APBS 0.3.2 User Guide. Adaptive Poisson-Boltzmann Solver
-
-
Baker, N.A.1
-
19
-
-
0035964342
-
-
Baker, N. A.; Sept, D.; Joseph, S.; Holst, M. J.; McCammon, J. A.; Proc. Natl. Acad. Sci. USA 2001, 98, 10037.
-
(2001)
Proc. Natl. Acad. Sci. USA
, vol.98
, pp. 10037
-
-
Baker, N.A.1
Sept, D.2
Joseph, S.3
Holst, M.J.4
McCammon, J.A.5
-
21
-
-
0000486193
-
-
Holst, M.; Baker, N.; Wang, F.; J. Comput. Chem. 2000, 21, 1319.
-
(2000)
J. Comput. Chem.
, vol.21
, pp. 1319
-
-
Holst, M.1
Baker, N.2
Wang, F.3
-
22
-
-
0000486194
-
-
Baker, N.; Holst, M.; Wang, F.; J. Comput. Chem., 2000, 21, 1343.
-
(2000)
J. Comput. Chem.
, vol.21
, pp. 1343
-
-
Baker, N.1
Holst, M.2
Wang, F.3
-
23
-
-
0035327566
-
-
Baker, N. A.; Sept, D.; Holst, M. J.; McCammon, J. A.; IBM J. Res. Dev. 2001, 45, 427.
-
(2001)
IBM J. Res. Dev.
, vol.45
, pp. 427
-
-
Baker, N.A.1
Sept, D.2
Holst, M.J.3
McCammon, J.A.4
-
24
-
-
0029881007
-
-
Koradi, R.; Billeter, M.; Wüthrich, K.; J. Mol. Graph. 1996, 14, 51.
-
(1996)
J. Mol. Graph.
, vol.14
, pp. 51
-
-
Koradi, R.1
Billeter, M.2
Wüthrich, K.3
-
25
-
-
85039246789
-
-
Grace Development Team, Copyright (c) 1996-2004 accessed in august 2004
-
Turner, P. J.; Grace Development Team [http://plasmagate.weizmann.ac.il/ Grace/], Copyright (c) 1996-2004 accessed in august 2004.
-
-
-
Turner, P.J.1
-
26
-
-
0000243829
-
-
Laskowski, R. A.; Macarthur, M. W.; Moss, D. S.; Thornton, J. M.; J. Appl. Cryst. 1993, 26, 283.
-
(1993)
J. Appl. Cryst.
, vol.26
, pp. 283
-
-
Laskowski, R.A.1
Macarthur, M.W.2
Moss, D.S.3
Thornton, J.M.4
-
27
-
-
0034681279
-
-
Koellner, G.; Kryger, G.; Millard, C. B.; Silman, I.; Sussman, J. L.; Steiner, T.; J. Mol. Biol. 2000, 296, 713.
-
(2000)
J. Mol. Biol.
, vol.296
, pp. 713
-
-
Koellner, G.1
Kryger, G.2
Millard, C.B.3
Silman, I.4
Sussman, J.L.5
Steiner, T.6
-
28
-
-
0029742777
-
-
Shafferman, A.; Ordentlich, A.; Barak, D.; Stein, D.; Ariel, N.; Velan, B.; Biochem. J. 1996, 318, 833.
-
(1996)
Biochem. J.
, vol.318
, pp. 833
-
-
Shafferman, A.1
Ordentlich, A.2
Barak, D.3
Stein, D.4
Ariel, N.5
Velan, B.6
-
29
-
-
0035252801
-
-
Enyedy, I. J.; Kovach, I. M.; Bencsura, A.; Biochem. J. 2001, 353, 645.
-
(2001)
Biochem. J.
, vol.353
, pp. 645
-
-
Enyedy, I.J.1
Kovach, I.M.2
Bencsura, A.3
-
30
-
-
0032190343
-
-
Ariel, N. Ordentlich, A.; Barak, D.; Bino, T.; Velan, B.; Shafferman, A.; Biochem. J. 1998, 335, 95.
-
(1998)
Biochem. J.
, vol.335
, pp. 95
-
-
Ariel, N.1
Ordentlich, A.2
Barak, D.3
Bino, T.4
Velan, B.5
Shafferman, A.6
-
31
-
-
85039243541
-
-
note
-
We thank the referee for this suggestion.
-
-
-
-
32
-
-
0141754089
-
-
Bui, J. M.; Henchman, R. H.; McCammon, J. A.; Biophys. J. 2003, 85, 2267.
-
(2003)
Biophys. J.
, vol.85
, pp. 2267
-
-
Bui, J.M.1
Henchman, R.H.2
McCammon, J.A.3
-
33
-
-
0034906622
-
-
Tai, K.; Shen, T.; Börjesson, U.; Philipoulos, M.; McCammon, J. A.; Biophys. J. 2001, 81, 715.
-
(2001)
Biophys. J.
, vol.81
, pp. 715
-
-
Tai, K.1
Shen, T.2
Börjesson, U.3
Philipoulos, M.4
McCammon, J.A.5
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