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Journal of Molecular Modeling|May 2, 2008
Application of the PM6 method to modeling the solid stateJames J P StewartJournal of Molecular Modeling|April 17, 2008
Probing the interactions of the solvated electron with DNA by molecular dynamics simulations: bromodeoxyuridine substituted DNATsvetan G Gantchev, Darel J HuntingJournal of Molecular Modeling|January 16, 2008
Electrostatic interactions play an essential role in DNA repair and cold-adaptation of uracil DNA glycosylaseMagne Olufsen, Arne O Smalås, Bjørn O BrandsdalJournal of Molecular Modeling|October 13, 2009
Molecular dynamics simulation of a carboxy murine neuroglobin mutated on the proximal side: heme displacement and concomitant rearrangement in loop regionsJia Xu, Guowei Yin, Feijuan Huang, et al.Journal of Molecular Modeling|October 13, 2009
Topological analysis of aromatic halogen/hydrogen bonds by electron charge density and electrostatic potentialsDarío J R Duarte, Margarita M de las Vallejos, Nélida M PeruchenaJournal of Molecular Modeling|October 13, 2009
Structural basis for decreased affinity of Emodin binding to Val66-mutated human CK2 alpha as determined by molecular dynamicsNa Zhang, Rugang ZhongJournal of Molecular Modeling|October 10, 2009
A systematic study of the stabilities of cyclic boryl anionsChin-Hung Lai, Pi-Tai ChouJournal of Molecular Modeling|September 1, 2019
Position-dependent mass Schrödinger equation for exponential-type potentialsG Ovando, J J Peña, J Morales, et al.Journal of Molecular Modeling|January 31, 2021
Role of water in the determination of protonation states of titratable residuesSyeda Rehana ZiaJournal of Molecular Modeling|January 31, 2021
Identification of new BACE1 inhibitors for treating Alzheimer's diseasePragya Kushwaha, Vineeta Singh, Pallavi Somvanshi, et al.Pageof 695