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JCC
2002
54views more  JCC 2002»
15 years 1 months ago
Conformational analysis: A new approach by means of chemometrics
Aline Thaís Bruni, Vitor B. P. Leite, M&aac...
JCC
2002
52views more  JCC 2002»
15 years 1 months ago
Predicted solution structure of zymogen human coagulation FVII
Lalith E. Perera, Thomas A. Darden, Lee G. Pederse...
90
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JCC
2002
51views more  JCC 2002»
15 years 1 months ago
PDDG/PM3 and PDDG/MNDO: Improved semiempirical methods
Matthew P. Repasky, Jayaraman Chandrasekhar, Willi...
69
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JCC
1998
66views more  JCC 1998»
15 years 1 months ago
Searching for saddle points of potential energy surfaces by following a reduced gradient
Wolfgang Quapp, Michael Hirsch, Olaf Imig, Dietmar...
77
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JCC
1998
120views more  JCC 1998»
15 years 1 months ago
Development of a parallel molecular dynamics code on SIMD computers: Algorithm for use of pair list criterion
Danilo Roccatano, R. Bizzarri, G. Chillemi, N. San...