专利名称:Computer based modeling system发明人:Mohammad Afshar,Stephen Morley申请号:US09747715申请日:20001222
公开号:US20020045168A1公开日:20020418
摘要:A method for defining a binding site in a biological macromolecule based on atwo-sphere grid and a method for determining the free energy of a ligand:RNA structurebased on pseudo-energy values. These methods can be use in docking and also in high-throughput in silico screening of ligand libraries against an RNA structure of interest.
申请人:AFSHAR MOHAMMAD,MORLEY STEPHEN
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