-
9
-
-
0029921058
-
-
Thoden, J. B.; Frey, P. A.; Holden, H. M. Biochemistry 1996, 35, 5137-5144.
-
(1996)
Biochemistry
, vol.35
, pp. 5137-5144
-
-
Thoden, J.B.1
Frey, P.A.2
Holden, H.M.3
-
10
-
-
0031959116
-
-
Kawakita, M.; Ishida, N.; Miura, N.; Sun-Wada, G.-H.; Yoshioka, S. J. Biochem. 1998, 123, 777-785.
-
(1998)
J. Biochem.
, vol.123
, pp. 777-785
-
-
Kawakita, M.1
Ishida, N.2
Miura, N.3
Sun-Wada, G.-H.4
Yoshioka, S.5
-
13
-
-
0021757436
-
-
Weiner, S. J.; Kollman, P. A.; Case, D. A.; Singh, U. C.; Chio, C.; Alagona, G., Profeta, S.; Weiner, P. J. Am. Chem. Soc. 1984, 106, 765-764.
-
(1984)
J. Am. Chem. Soc.
, vol.106
, pp. 765-1764
-
-
Weiner, S.J.1
Kollman, P.A.2
Case, D.A.3
Singh, U.C.4
Chio, C.5
Alagona, G.6
Profeta, S.7
Weiner, P.8
-
14
-
-
84986512474
-
-
Brooks, B. R.; Bruccoleri, R. E.; Olafson, B. D.; States, D. J.; Swaminathan, S.; Karplus, M. J. Comput. Chem. 1983, 4, 187-217.
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 187-217
-
-
Brooks, B.R.1
Bruccoleri, R.E.2
Olafson, B.D.3
States, D.J.4
Swaminathan, S.5
Karplus, M.6
-
15
-
-
0344014575
-
-
Koehler, J. E. H.; Saenger, W.; van Gunsteren W, F. Eur. Biophys. J. 1987, 15, 97.
-
(1987)
Eur. Biophys. J.
, vol.15
, pp. 97
-
-
Koehler, J.E.H.1
Saenger, W.2
Van Gunsteren, W.F.3
-
16
-
-
0029912748
-
-
Jorgensen, W. L.; Maxwell, D. S.; Tirado-Rives, J. J. Am. Chem. Soc. 1995, 178, 11225.
-
(1995)
J. Am. Chem. Soc.
, vol.178
, pp. 11225
-
-
Jorgensen, W.L.1
Maxwell, D.S.2
Tirado-Rives, J.3
-
17
-
-
33751155339
-
-
Woods, R. J.; Dwek, R. A.; Edge, C. J.; Fraser-Reid, B. J. Phys. Chem. 1995, 99, 3832-3846.
-
(1995)
J. Phys. Chem.
, vol.99
, pp. 3832-3846
-
-
Woods, R.J.1
Dwek, R.A.2
Edge, C.J.3
Fraser-Reid, B.4
-
23
-
-
43949148902
-
-
Koča, J.; Kriz, Z.; Carlsen, P. H. J. J. Mol. Struct. 1994, 306, 157-164.
-
(1994)
J. Mol. Struct.
, vol.306
, pp. 157-164
-
-
Koča, J.1
Kriz, Z.2
Carlsen, P.H.J.3
-
25
-
-
0342820699
-
-
Koča, J.; Pérez, S.; Imberty, A. J. Comput. Chem. 1995, 16, 796-310.
-
(1995)
J. Comput. Chem.
, vol.16
, pp. 796-1310
-
-
Koča, J.1
Pérez, S.2
Imberty, A.3
-
26
-
-
0028846769
-
-
Engelsen, S. B.; Pérez, S.; Braccini, I.; Hervé du Penhoat, C.; Koča, J. Carbohydr. Res. 1995, 276, 1-29.
-
(1995)
Carbohydr. Res.
, vol.276
, pp. 1-29
-
-
Engelsen, S.B.1
Pérez, S.2
Braccini, I.3
Hervé Du Penhoat, C.4
Koča, J.5
-
27
-
-
0029014988
-
-
Imberty, A.; Mikros, E.; Koča, J.; Mollicone, R.; Oriol, R.; Pérez, S. Glycoconjugate J. 1995, 12, 331-349.
-
(1995)
Glycoconjugate J.
, vol.12
, pp. 331-349
-
-
Imberty, A.1
Mikros, E.2
Koča, J.3
Mollicone, R.4
Oriol, R.5
Pérez, S.6
-
28
-
-
0004133516
-
-
Gaussian Inc., Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman, J. R.; Keith, T.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andres, J. L.; Replogle, E. S.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; Defrees, D. J.; Baker, J.; Stewart, J. P.; Head-Gordon, M.; Gonzalez, C.; Pople, J. A. Gaussian-94, Gaussian Inc., Pittsburgh, PA, 1995.
-
(1995)
Gaussian-94
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
Chen, W.22
Wong, M.W.23
Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
Martin, R.L.27
Fox, D.J.28
Binkley, J.S.29
Defrees, D.J.30
Baker, J.31
Stewart, J.P.32
Head-Gordon, M.33
Gonzalez, C.34
Pople, J.A.35
more..
-
30
-
-
84986516411
-
-
Cieplak, P.; Cornell, W. D.; Bayly, C.; Kollman, P. A. J. Comput. Chem. 1995, 11, 1357-1377.
-
(1995)
J. Comput. Chem.
, vol.11
, pp. 1357-1377
-
-
Cieplak, P.1
Cornell, W.D.2
Bayly, C.3
Kollman, P.A.4
-
32
-
-
0002965418
-
-
London
-
Edward, J. T. Chem. Ind. (London) 1955, 1102-1104.
-
(1955)
Chem. Ind.
, pp. 1102-1104
-
-
Edward, J.T.1
-
35
-
-
0014220797
-
-
Berman, H. M.; Chu, S. S. C.; Jeffrey, G. A. Science 1967, 157, 1576-1577.
-
(1967)
Science
, vol.157
, pp. 1576-1577
-
-
Berman, H.M.1
Chu, S.S.C.2
Jeffrey, G.A.3
-
40
-
-
0001015978
-
-
Pavelites, J. J.; Gao, J.; Bash, A. B.; Mackerell A. D., Jr. J. Comput. Chem. 1997, 18, 221-239.
-
(1997)
J. Comput. Chem.
, vol.18
, pp. 221-239
-
-
Pavelites, J.J.1
Gao, J.2
Bash, A.B.3
Mackerell A.D., Jr.4
-
46
-
-
0344877632
-
-
Sybyl 6.4, Tripos Associates, 1699 S. Hanley Road, Suite 303, St Louis, MO 63144
-
Sybyl 6.4, Tripos Associates, 1699 S. Hanley Road, Suite 303, St Louis, MO 63144.
-
-
-
-
47
-
-
24544466805
-
-
Unpublished "in house" software
-
Koča, J.; Carlsen, P. H. J. Unpublished "in house" software, 1995.
-
(1995)
-
-
Koča, J.1
Carlsen, P.H.J.2
-
48
-
-
0345308805
-
-
"in house" program
-
Kriz, Z. "in house" program, 1998.
-
(1998)
-
-
Kriz, Z.1
-
49
-
-
0017398275
-
-
Saenger, W.; Ready, B. S.; Mühlegger, K.; Weimann, G. Nature 1977, 267, 225-229.
-
(1977)
Nature
, vol.267
, pp. 225-229
-
-
Saenger, W.1
Ready, B.S.2
Mühlegger, K.3
Weimann, G.4
-
50
-
-
0018121584
-
-
Holbrook, S. R.; Sussman, J. L.; Warrant, R. W.; Kim, S. H. J. Mol. Biol. 1978, 123, 631-660.
-
(1978)
J. Mol. Biol.
, vol.123
, pp. 631-660
-
-
Holbrook, S.R.1
Sussman, J.L.2
Warrant, R.W.3
Kim, S.H.4
-
51
-
-
33646940952
-
-
Ryckaert, J. P.; Ciccotti, G.; Berendsen, H. J. C. J. Comput. Phys. 1977, 23, 327-341.
-
(1977)
J. Comput. Phys.
, vol.23
, pp. 327-341
-
-
Ryckaert, J.P.1
Ciccotti, G.2
Berendsen, H.J.C.3
-
52
-
-
33750587438
-
-
Berendsen, H. J. C.; Postma, J. P. M.; van Gunsteren, W. F.; DiNola, A.; Haak, J. R. J. Comput. Phys. 1984, 81, 3684-3690.
-
(1984)
J. Comput. Phys.
, vol.81
, pp. 3684-3690
-
-
Berendsen, H.J.C.1
Postma, J.P.M.2
Van Gunsteren, W.F.3
Dinola, A.4
Haak, J.R.5
-
53
-
-
33645961739
-
-
Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pedersen, L. G. J. Chem. Phys. 1995, 103, 8577-8593.
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577-8593
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pedersen, L.G.6
-
54
-
-
0024276072
-
-
Oikonomakos, N.; Acharya, K. R.; Stuart, D. I.; Melpidou, A. E.; McLaughlin, P. J.; Jonhson, L. Eur. J. Biochem., 1988, 173, 569-578.
-
(1988)
Eur. J. Biochem.
, vol.173
, pp. 569-578
-
-
Oikonomakos, N.1
Acharya, K.R.2
Stuart, D.I.3
Melpidou, A.E.4
McLaughlin, P.J.5
Jonhson, L.6
|