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Journal of Medicinal Chemistry|May 26, 2025
The Logic of Chemical OptimizationDavid C Kombo, Matthew J LaMarcheProteins|May 29, 2024
Application of artificial intelligence and machine learning techniques to the analysis of dynamic protein sequencesDavid C Kombo, Matthew J LaMarche, Chilaluck C Konkankit, et al.ACS Omega|July 8, 2024
Predictions of Colloidal Molecular Aggregation Using AI/ML ModelsDavid C Kombo, J David Stepp, Sungtaek Lim, et al.Journal of Chemical Information and Modeling|December 17, 2013
Comparative study on the use of docking and Bayesian categorization to predict ligand binding to nicotinic acetylcholine receptors (nAChRs) subtypesDavid C Kombo, Merouane BencherifBioorganic & Medicinal Chemistry Letters|August 14, 2013
Computational studies of novel carbonyl-containing diazabicyclic ligands interacting with α4β2 nicotinic acetylcholine receptor (nAChR) reveal alternative binding modesDavid C Kombo, Anatoly A Mazurov, Jon-Paul Strachan, et al.Bioorganic & Medicinal Chemistry Letters|July 27, 2013
QM-polarized ligand docking accurately predicts the trend in binding affinity of a series of arylmethylene quinuclidine-like derivatives at the α4β2 and α3β4 nicotinic acetylcholine receptors (nAChRs)David C Kombo, Vladimir P Grinevich, Terry A Hauser, et al.Antimicrobial Agents and Chemotherapy|May 31, 2012
Efficacy of LFF571 in a hamster model of Clostridium difficile infectionAnna Trzasko, Jennifer A Leeds, Jens Praestgaard, et al.Bioorganic & Medicinal Chemistry Letters|June 28, 2005
Discodermolide analogues as the chemical component of combination bacteriolytic therapyAmos B Smith, B Scott Freeze, Matthew J LaMarche, et al.Journal of Chemical Information and Modeling|December 19, 2012
3D molecular descriptors important for clinical successDavid C Kombo, Kartik Tallapragada, Rachit Jain, et al.Pageof 5