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by GiovanniRoviello
Thu Dec 02, 2021 3:21 pm
Forum: Main Forum
Topic: ligand preparation + binding energies and VDW/HB scores
Replies: 1
Views: 1954

ligand preparation + binding energies and VDW/HB scores

Dear All, 1-Is it necessary to add H to ligand structures before docking? I tried both with and without and results are not the same 2-is it possible to get binding energies (kcal/mol), and the VDW and HB scores after each docking? I see mentioned these two latters but I do not see the numeric value...