Ligand-receptor interactions, contribution of the nitro group and MMPBSA energy for all compounds.
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资源简介：
HB denotes for hydrogen bond formation, VDW denotes for van der Waals interaction. 1: Extracted from the electrostatic term of the force field. 2: MMPBSA energy without computing the entropy contribution to binding.
创建时间：
2012-03-05
