Showing results (1951-1960 of 2,646) with videos related to
Sort By:
Pageof 265
Journal of Computer-Aided Molecular Design|September 1, 2026
Discovery of novel acridine based inhibitors of Bruton's tyrosine kinase (BTK) via pharmacophore modeling and machine learning-driven virtual screening followed by molecular dynamic studiesRand Shahin, Sawsan Jaafreh, Iman Mansi, et al.Journal of Computer-Aided Molecular Design|September 5, 2026
A novel framework for the discovery of MAPK-activated protein kinase 2 (MAPKAPK2) inhibitors using a multi-feature deep learning ensembleHayden Chen, Yi-Wen Wu, Tony Eight Lin, et al.Journal of Computer-Aided Molecular Design|April 1, 1992
A pseudoreceptor docking study of 4,5-alpha-epoxymorphinans with a range of dielectric constantsR Gussio, S Pou, J H Chen, et al.Journal of Computer-Aided Molecular Design|December 1, 1992
Comparative molecular field analysis of CCK-A antagonists using field-fit as an alignment technique. A convenient guide to design new CCK-A ligandsS Rault, R Bureau, J C Pilo, et al.Journal of Computer-Aided Molecular Design|December 1, 1992
Surface comparisons of some odour molecules: conformational calculations on sandalwood odour VG Buchbauer, S Winiwarter, P WolschannJournal of Computer-Aided Molecular Design|October 14, 2010
Prodrugs of aza nucleosides based on proton transfer reactionRafik KaramanJournal of Computer-Aided Molecular Design|November 25, 2010
Catalytic residues in hydrolases: analysis of methods designed for ligand-binding site predictionKatarzyna Prymula, Tomasz Jadczyk, Irena RotermanJournal of Computer-Aided Molecular Design|November 10, 2010
In silico strategies for the selection of chelating compounds with potential application in metal-promoted neurodegenerative diseasesCristina Rodríguez-Rodríguez, Albert Rimola, Jorge Alí-Torres, et al.Journal of Computer-Aided Molecular Design|January 18, 2011
Applying forces to elastic network models of large biomolecules using a haptic feedback deviceM B Stocks, S D Laycock, S HaywardJournal of Computer-Aided Molecular Design|January 18, 2011
Structural-dynamical investigation of the ZnuA histidine-rich loop: involvement in zinc management and transportMattia Falconi, Francesco Oteri, Francesco Di Palma, et al.Pageof 265