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JCC
2002
51views more  JCC 2002»
14 years 11 months ago
PDDG/PM3 and PDDG/MNDO: Improved semiempirical methods
Matthew P. Repasky, Jayaraman Chandrasekhar, Willi...
JCC
2002
52views more  JCC 2002»
14 years 11 months ago
Predicted solution structure of zymogen human coagulation FVII
Lalith E. Perera, Thomas A. Darden, Lee G. Pederse...
JCC
2002
54views more  JCC 2002»
14 years 11 months ago
Conformational analysis: A new approach by means of chemometrics
Aline Thaís Bruni, Vitor B. P. Leite, M&aac...
JCC
2002
49views more  JCC 2002»
14 years 11 months ago
Support vector machines for predicting HIV protease cleavage sites in protein
Yu-Dong Cai, Xiao-Jun Liu, Xue-biao Xu, Kuo-Chen C...
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JCC
2002
101views more  JCC 2002»
14 years 11 months ago
Parameterization of OPLS-AA force field for the conformational analysis of macrocyclic polyketides
: The parameters for the OPLS
Kalju Kahn, Thomas C. Bruice