-
1
-
-
0022419375
-
-
Burley, S. K., and Petsko, G. A., 1985, Science, 229, 23.
-
(1985)
Science
, vol.229
, pp. 23
-
-
Burley, S.K.1
Petsko, G.A.2
-
2
-
-
33845377147
-
-
Deakyne, C. A., and Meot-Ner, M., 1985, J. Amer. chem. Soc., 107, 474.
-
(1985)
J. Amer. Chem. Soc.
, vol.107
, pp. 474
-
-
Deakyne, C.A.1
Meot-Ner, M.2
-
3
-
-
0038100343
-
-
Sunner, J., Nishizawa, K., and Kebarle, P., 1981, J. phys. Chem., 85, 1814.
-
(1981)
J. Phys. Chem.
, vol.85
, pp. 1814
-
-
Sunner, J.1
Nishizawa, K.2
Kebarle, P.3
-
5
-
-
0000192455
-
-
Duan, G., Smith Jr., V. H., and Weaver, D. F., 1999, Chem. Phys. Lett., 310, 323.
-
(1999)
Chem. Phys. Lett.
, vol.310
, pp. 323
-
-
Duan, G.1
Smith, V.H.2
Weaver, D.F.3
-
6
-
-
0034682341
-
-
Duan, G., Smith, Jr., V. H., and Weaver, D. F., 2000, J. phys. Chem. A, 104, 4521.
-
(2000)
J. Phys. Chem. A
, vol.104
, pp. 4521
-
-
Duan, G.1
Smith, V.H.2
Weaver, D.F.3
-
7
-
-
0034300761
-
-
Duan, G., Smith Jr., V. H., and Weaver, D. F., 2000, Intl J. Quantum Chem., 80, 44.
-
(2000)
Intl J. Quantum Chem.
, vol.80
, pp. 44
-
-
Duan, G.1
Smith, V.H.2
Weaver, D.F.3
-
8
-
-
0029151201
-
-
Chakrabarti, P., and Samanta, U., 1995, J. molec. Biol., 251, 9.
-
(1995)
J. Molec. Biol.
, vol.251
, pp. 9
-
-
Chakrabarti, P.1
Samanta, U.2
-
9
-
-
85022734135
-
-
Kim, K. S., Lee, J. Y., Lee, S. J., Ha, T., and Kim, D. H., 1994, J. Amer. chem. Soc., 116, 7399.
-
(1994)
J. Amer. Chem. Soc.
, vol.116
, pp. 7399
-
-
Kim, K.S.1
Lee, J.Y.2
Lee, S.J.3
Ha, T.4
Kim, D.H.5
-
10
-
-
0027368530
-
-
Harel, M., Schalk, I., Bouet, F., Goeldner, M., Hirth, C., Axelsen, P. H., Silman, I., and Sussman, J. L., 1993, Proc. Natl Acad. Sci. USA, 90, 9031.
-
(1993)
Proc. Natl Acad. Sci. USA
, vol.90
, pp. 9031
-
-
Harel, M.1
Schalk, I.2
Bouet, F.3
Goeldner, M.4
Hirth, C.5
Axelsen, P.H.6
Silman, I.7
Sussman, J.L.8
-
11
-
-
0000162332
-
-
Suzuki, S., Green, P. G., Bumgarner, R. E., Dasgupta, S., Goddard, W. A., and Blake, G. A., 1992, Science, 257, 942.
-
(1992)
Science
, vol.257
, pp. 942
-
-
Suzuki, S.1
Green, P.G.2
Bumgarner, R.E.3
Dasgupta, S.4
Goddard, W.A.5
Blake, G.A.6
-
12
-
-
0000408464
-
-
Atwood, J. L., Hamada, F., Robinson, K. D., Orr, G. W., and Vincent, R. L., 1991, Nature, 349, 683.
-
(1991)
Nature
, vol.349
, pp. 683
-
-
Atwood, J.L.1
Hamada, F.2
Robinson, K.D.3
Orr, G.W.4
Vincent, R.L.5
-
13
-
-
0026698924
-
-
Wasksman, G. et al., 1992, Nature, 358, 646.
-
(1992)
Nature
, vol.358
, pp. 646
-
-
Wasksman, G.1
-
14
-
-
0001444717
-
-
Rodham, D. A., Susuki, S., Suenram, R. D., Lovas, F. J., Dasgupta, S., Goddard, W. A., and Blake, G. A., 1993, Nature, 362, 735.
-
(1993)
Nature
, vol.362
, pp. 735
-
-
Rodham, D.A.1
Susuki, S.2
Suenram, R.D.3
Lovas, F.J.4
Dasgupta, S.5
Goddard, W.A.6
Blake, G.A.7
-
15
-
-
0001931343
-
-
Adams, H., Harris, K. D. M., Hembury, G. A., Hunler, C. A., Livingston, D., and McCabe, J. F., 1996, Chem. Commun., 2531.
-
(1996)
Chem. Commun.
, pp. 2531
-
-
Adams, H.1
Harris, K.D.M.2
Hembury, G.A.3
Hunler, C.A.4
Livingston, D.5
McCabe, J.F.6
-
16
-
-
84947142304
-
-
Chalasinski, G., and Szczesniak, M. M., 1988, Molec. Phys., 63, 205.
-
(1988)
Molec. Phys.
, vol.63
, pp. 205
-
-
Chalasinski, G.1
Szczesniak, M.M.2
-
17
-
-
0001267887
-
-
Chalasinski, G., Szczesniak, M. M., and Cybulski, S. M., 1990, J. chem. Phys., 92, 2481.
-
(1990)
J. Chem. Phys.
, vol.92
, pp. 2481
-
-
Chalasinski, G.1
Szczesniak, M.M.2
Cybulski, S.M.3
-
18
-
-
36449001286
-
-
Sadlej, J., and Buch, V., 1994, J. chem. Phys., 100, 4272.
-
(1994)
J. Chem. Phys.
, vol.100
, pp. 4272
-
-
Sadlej, J.1
Buch, V.2
-
19
-
-
36449000486
-
-
Gutowski, M., and Chalansinski, G. J., 1993, J. chem. Phys., 98, 5540.
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 5540
-
-
Gutowski, M.1
Chalansinski, G.J.2
-
20
-
-
36549104448
-
-
Liu, B., and Mclean, A. D., 1989, J. chem. Phys., 91, 2348.
-
(1989)
J. Chem. Phys.
, vol.91
, pp. 2348
-
-
Liu, B.1
McLean, A.D.2
-
21
-
-
0011051642
-
-
Yang, J., and Kestner, N. R., 1991, J. phys. Chem., 95, 9241.
-
(1991)
J. Phys. Chem.
, vol.95
, pp. 9241
-
-
Yang, J.1
Kestner, N.R.2
-
22
-
-
29244478742
-
-
Eggenberger, R., Gerber, R., Huber, S., and Searls, D., 1991, Chem. Phys. Lett., 183, 223.
-
(1991)
Chem. Phys. Lett.
, vol.183
, pp. 223
-
-
Eggenberger, R.1
Gerber, R.2
Huber, S.3
Searls, D.4
-
23
-
-
84890021933
-
-
Boys, S. F., and Bernardi, F., 1970, Molec. Phys., 19, 553.
-
(1970)
Molec. Phys.
, vol.19
, pp. 553
-
-
Boys, S.F.1
Bernardi, F.2
-
24
-
-
0002588301
-
-
Brown, R. D., Godfrey, P. D., and Kleibomer, B. K., 1987, J. molec. Spectrosc., 124, 34.
-
(1987)
J. Molec. Spectrosc.
, vol.124
, pp. 34
-
-
Brown, R.D.1
Godfrey, P.D.2
Kleibomer, B.K.3
-
25
-
-
84871008794
-
-
(Pittsburgh, PA: Gaussian, Inc.)
-
Frisch, M. J., Trucks, G. W., Head-Gordon, M., Gill, P. M. W., Wong, M. W., Foresman, J. B., Johnson, B. G., Schlegel, H. B., Robb, M. A., Replogle, E. S., Gomperts, R., Andres, J. L., Raghavachari, K., Binkley, J. S., Gonzalez, C., Martin, R. L., Fox, D. J., DeFrees, D. J., Baker, J., Stewart, J. J. P., and Pople, J. A., 1994, Gaussian94 (Pittsburgh, PA: Gaussian, Inc.).
-
(1994)
Gaussian94
-
-
Frisch, M.J.1
Trucks, G.W.2
Head-Gordon, M.3
Gill, P.M.W.4
Wong, M.W.5
Foresman, J.B.6
Johnson, B.G.7
Schlegel, H.B.8
Robb, M.A.9
Replogle, E.S.10
Gomperts, R.11
Andres, J.L.12
Raghavachari, K.13
Binkley, J.S.14
Gonzalez, C.15
Martin, R.L.16
Fox, D.J.17
DeFrees, D.J.18
Baker, J.19
Stewart, J.J.P.20
Pople, J.A.21
more..
-
26
-
-
77956757640
-
-
Bernstein, F. C., Koetzle, T. F., Williams, G. J. B., Mayer, G. F., Brice, M. D., Rodgers, J. R., Kennard, O., Shimanouchi, T., and Tasami, M., 1997, J. molec. Biol., 112, 535.
-
(1997)
J. Molec. Biol.
, vol.112
, pp. 535
-
-
Bernstein, F.C.1
Koetzle, T.F.2
Williams, G.J.B.3
Mayer, G.F.4
Brice, M.D.5
Rodgers, J.R.6
Kennard, O.7
Shimanouchi, T.8
Tasami, M.9
-
27
-
-
0029094346
-
-
Lazaridis, T., Archontis, G., and Karplus, M., 1995, Adv. Protein Chem., 47, 231.
-
(1995)
Adv. Protein Chem.
, vol.47
, pp. 231
-
-
Lazaridis, T.1
Archontis, G.2
Karplus, M.3
-
28
-
-
0038774655
-
-
Jaffe, R., and Smith, G. D., 1996, J. chem. Phys., 105, 2780.
-
(1996)
J. Chem. Phys.
, vol.105
, pp. 2780
-
-
Jaffe, R.1
Smith, G.D.2
-
29
-
-
0037721149
-
-
Hobza, P., Heinrich, L., Schlag, E. W., 1996, J. phys. Chem., 100, 18790.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 18790
-
-
Hobza, P.1
Heinrich, L.2
Schlag, E.W.3
-
30
-
-
0010974811
-
-
Sponer, J., and Hobza, P., 1997, Chem. Phys. Lett., 267, 163.
-
(1997)
Chem. Phys. Lett.
, vol.267
, pp. 163
-
-
Sponer, J.1
Hobza, P.2
-
31
-
-
36449006439
-
-
Henson, B. F., Hartland, G. V., Venturo, V. A., and Felker, P. M. J., 1992, J. chem. Phys., 97, 2189.
-
(1992)
J. Chem. Phys.
, vol.97
, pp. 2189
-
-
Henson, B.F.1
Hartland, G.V.2
Venturo, V.A.3
Felker, P.M.J.4
-
33
-
-
0030001537
-
-
Chipot, C., Jaffe, R., Maigret, B., Pearlman, D. A., and Kollman, P. A., 1996, J. Amer. chem. Soc., 118, 11217.
-
(1996)
J. Amer. Chem. Soc.
, vol.118
, pp. 11217
-
-
Chipot, C.1
Jaffe, R.2
Maigret, B.3
Pearlman, D.A.4
Kollman, P.A.5
-
34
-
-
0011012944
-
-
Vedani, A., and Dunitz, J. D., 1985, J. Amer. chem. Soc., 107, 765.
-
(1985)
J. Amer. Chem. Soc.
, vol.107
, pp. 765
-
-
Vedani, A.1
Dunitz, J.D.2
|