-
1
-
-
0034945996
-
-
2001
-
Amicosante, M.; Sanarico, N.; Berretta, F.; Arroyo, J.; Lombardi, G.; Lechler, R.; Colizzi, V.; Saltini, C. 2001. Hum. Immunol. 2001, 43, 686.
-
(2001)
Hum. Immunol.
, vol.43
, pp. 686
-
-
Amicosante, M.1
Sanarico, N.2
Berretta, F.3
Arroyo, J.4
Lombardi, G.5
Lechler, R.6
Colizzi, V.7
Saltini, C.8
-
3
-
-
0037292396
-
-
Scott, B. L.; Wang, Z.; Marrone, B. L.; Sauer, N. N. J. Inorg. Chem. 2003, 94, 5.
-
(2003)
J. Inorg. Chem.
, vol.94
, pp. 5
-
-
Scott, B.L.1
Wang, Z.2
Marrone, B.L.3
Sauer, N.N.4
-
4
-
-
0004133516
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A.; Stratmann, R. E., Jr.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Baboul, A. G.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Andres, J. L.; Gonzalez, C.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.7; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98, Revision A.7
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery, J.A.8
Stratmann Jr., R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Baboul, A.G.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
Keith, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Gonzalez, C.49
Challacombe, M.50
Gill, P.M.W.51
Johnson, B.52
Chen, W.53
Wong, M.W.54
Andres, J.L.55
Gonzalez, C.56
Head-Gordon, M.57
Replogle, E.S.58
Pople, J.A.59
more..
-
5
-
-
0347504481
-
-
Snyder, J. A.; Weston, W.; Tinkle, S.; Demchuk, E. Environ. Health Perspect. 2003, 111 (15), 1827-1834.
-
(2003)
Environ. Health Perspect.
, vol.111
, Issue.15
, pp. 1827-1834
-
-
Snyder, J.A.1
Weston, W.2
Tinkle, S.3
Demchuk, E.4
-
6
-
-
84986512474
-
CHARMM: A program for macromolecular energy, minimization and dynamics calculations
-
Brooks, B. B.; Broccoleri, R. E.; Olafson, B. D.; States, D. J.; Swaminathan, S.; Karplus, M. CHARMM: a program for macromolecular energy, minimization and dynamics calculations. J. Comput. Chem. 1983, 4, 187-217.
-
(1983)
J. Comput. Chem.
, vol.4
, pp. 187-217
-
-
Brooks, B.B.1
Broccoleri, R.E.2
Olafson, B.D.3
States, D.J.4
Swaminathan, S.5
Karplus, M.6
-
8
-
-
33846823909
-
Particle mesh Ewald-an Nlog(N) method for Ewald sums in large systems
-
Darden, T.; York, D.; Pedersen, L. Particle mesh Ewald-an Nlog(N) method for Ewald sums in large systems. J. Chem. Phys. 1993, 98, 10089-10092.
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 10089-10092
-
-
Darden, T.1
York, D.2
Pedersen, L.3
-
9
-
-
33645961739
-
A smooth particle mesh Ewald method
-
Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pedersen, L. G. A smooth particle mesh Ewald method. 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
-
10
-
-
33646940952
-
Numerical integration of the Cartesian equations of motion of a system with constraints: Molecular dynamics of n-alkanes
-
Ryckaert, J.-P.; Ciccotti, G.; Berendsen, H. J. C. Numerical integration of the Cartesian equations of motion of a system with constraints: Molecular dynamics of n-alkanes. 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
-
11
-
-
0347377133
-
-
Wong, M. W.; Wiberg, K. B.; Frisch, M. J. J. Chem. Phys. 1991, 95, 8991.
-
(1991)
J. Chem. Phys.
, vol.95
, pp. 8991
-
-
Wong, M.W.1
Wiberg, K.B.2
Frisch, M.J.3
-
12
-
-
0000113435
-
-
Kang, K. K.; Némethy, G.; Scheraga, H. A. J. Chem. Phys. 1987, 91, 4118.
-
(1987)
J. Chem. Phys.
, vol.91
, pp. 4118
-
-
Kang, K.K.1
Némethy, G.2
Scheraga, H.A.3
-
14
-
-
84887009086
-
-
Yamaguchi, T.; Ohtaki, H.; Spohr, G.; Pálinkás, K.; Heizinger, M. M. Z. Naturforsch. 1986, 41a, 1175.
-
(1986)
Z. Naturforsch.
, vol.41 A
, pp. 1175
-
-
Yamaguchi, T.1
Ohtaki, H.2
Spohr, G.3
Pálinkás, K.4
Heizinger, M.M.5
-
15
-
-
0026124585
-
-
Davis, M. E.; Madura, J. D.; Luty, B. A.; McCammon, J. A. Comput. Phys. Commun. 1991, 62, 187.
-
(1991)
Comput. Phys. Commun.
, vol.62
, pp. 187
-
-
Davis, M.E.1
Madura, J.D.2
Luty, B.A.3
McCammon, J.A.4
-
16
-
-
0029633152
-
-
Madura, J. D.; Briggs, J. M.; Wade, R. C.; Davis, M. E.; Luty, B. A.; Hin, A.; Antosiewicz, J.; Gilson, M. K.; Bagheri, B.; Scott, L. R.; McCammon, J. A. Comput. Phys. Commun. 1995, 91, 57.
-
(1995)
Comput. Phys. Commun.
, vol.91
, pp. 57
-
-
Madura, J.D.1
Briggs, J.M.2
Wade, R.C.3
Davis, M.E.4
Luty, B.A.5
Hin, A.6
Antosiewicz, J.7
Gilson, M.K.8
Bagheri, B.9
Scott, L.R.10
McCammon, J.A.11
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