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Journal of Molecular Modeling|March 7, 2007
Molecular docking study of the binding of aminopyridines within the K+ channelNorma Angélica Caballero, Francisco Javier Meléndez, Alfonso Niño, et al.Journal of Molecular Modeling|March 10, 2007
Interaction of copper organometallic precursors with barrier layers of Ti, Ta and W and their nitrides: a first-principles molecular dynamics studyEduardo Machado, Marcin Kaczmarski, Benoît Braida, et al.Journal of Molecular Modeling|March 14, 2007
Interaction energies in non-covalently bound intermolecular complexes derived using the subsystem formulation of density functional theoryMarcin Dułak, Tomasz A WesołowskiJournal of Molecular Modeling|June 16, 2007
AM1* parameters for copper and zincHakan Kayi, Timothy ClarkJournal of Molecular Modeling|June 15, 2007
A step on the path in the discovery of new latent fingerprint development reagents: substituted Ruhemann's purples and implications for the lawDanielle Sapse, Nicholas D K PetracoJournal of Molecular Modeling|July 6, 2007
Comment on "numerical treatment of two-center overlap integrals"Frank E HarrisJournal of Molecular Modeling|August 4, 2009
Homology modeling and atomic level binding study of Leishmania MAPK with inhibitorsMahendra Awale, Vivek Kumar, Parameswaran Saravanan, et al.Journal of Molecular Modeling|September 26, 2009
Receptor based 3D-QSAR to identify putative binders of Mycobacterium tuberculosis Enoyl acyl carrier protein reductaseAshutosh Kumar, Mohammad Imran SiddiqiJournal of Molecular Modeling|July 24, 2009
Anticancer activity of nucleoside analogues: a density functional theory based QSAR studyPubalee Sarmah, Ramesh C DekaJournal of Molecular Modeling|July 25, 2009
Combined DFT and NBO study on the electronic basis of Si...N-beta-donor bondBing Yin, YuanHe Huang, Guo Wang, et al.Pageof 699