Molecular docking scores (kcal/mol) and MM-GBSA binding energies (kcal/mol) for each target protein (PDB ID), including contributions from hydrogen bonds and vdW interactions.
收藏Figshare2026-02-13 更新2026-04-28 收录
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https://figshare.com/articles/dataset/_p_Molecular_docking_scores_kcal_mol_and_MM-GBSA_binding_energies_kcal_mol_for_each_target_protein_PDB_ID_including_contributions_from_hydrogen_bonds_and_vdW_interactions_p_/31335872
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Molecular docking scores (kcal/mol) and MM-GBSA binding energies (kcal/mol) for each target protein (PDB ID), including contributions from hydrogen bonds and vdW interactions.
创建时间：
2026-02-13
