Orientational sampling and rigid-body minimization in molecular docking revisited: on-the-fly optimization and degeneracy removal. [electronic resource]
- Journal of computer-aided molecular design Apr 1996
- 123-32 p. digital
Publication Type: Comparative Study; Journal Article; Research Support, Non-U.S. Gov't; Research Support, U.S. Gov't, P.H.S.
0920-654X
10.1007/BF00402820 doi
Algorithms Drug Design Enzymes--chemistry Ligands Models, Molecular Probability Protein Conformation