protein-ligand interactions Journal Article 4 Ligands 3 Research Support, Non-U.S. Gov't 3 drug design 3 3BN7M937V8 1 CGenFF 1 mehr ... Neonicotinoids 1 News 1 Nicotinic Agonists 1 Nitro Compounds 1 Proteins 1 Receptors, Nicotinic 1 Research Support, N.I.H., Extramural 1 X-ray crystallography 1 anticooperativity 1 binding affinity 1 cooperativity 1 database 1 electron-donating substituents 1 electron-withdrawing substituents 1 halobenzyl ring 1 imidacloprid 1 intermolecular interactions 1 local coupled cluster 1 local energy decomposition 1 machine learning 1 molecular dynamics simulation 1 molecular modeling 1 molecular recognition 1 weniger ...