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Journal of Molecular Modeling|July 24, 2008
Characterization of a candidate multi-pole molecular switch using computational techniquesDavood Farmanzadeh, Hassan SabzyanJournal of Molecular Modeling|October 7, 2006
Investigation of the structure of 6-amino-4-methylamino-5-nitrosopyrimidine by X-ray diffraction, NMR and molecular modelingGintaras Urbelis, Inga Susvilo, Sigitas TumkeviciusJournal of Molecular Modeling|March 31, 2007
Sequence analysis and rule development of predicting protein stability change upon mutation using decision tree modelLiang-Tsung Huang, M Michael Gromiha, Shinn-Ying HoJournal of Molecular Modeling|November 27, 2016
Ab initio and density functional theory (DFT) studies on triflic acid with water and protonated water clustersM Prakash, V SubramanianJournal of Molecular Modeling|November 27, 2016
Rotovibrational states of the water molecule on the sunBruno S Leite, Cristiano C Bastos, Antonio C PavãoJournal of Molecular Modeling|August 12, 2020
Computational investigation for modeling the protein-protein interaction of TasA(28-261)-TapA(33-253): a decisive process in biofilm formation by Bacillus subtilisNidhi Verma, Shubham Srivastava, Ruchi Malik, et al.Journal of Molecular Modeling|August 14, 2020
Investigation of nanoparticle-polymer interaction in bio-based nanosilica-filled PLA/NR nanocomposites: molecular dynamics simulationMahsa Nematollahi, Azam Jalali-Arani, Karim Golzar, et al.Journal of Molecular Modeling|August 14, 2020
Computational analysis of complement inhibitor compstatin using molecular dynamicsDidier Devaurs, Dinler A Antunes, Lydia E KavrakiJournal of Molecular Modeling|March 10, 2015
Analysis of the flexibility and stability of the structure of magainin in a bilayer, and in aqueous and nonaqueous solutions using molecular dynamics simulationsElham Esmaili, Mohsen ShahlaeiJournal of Molecular Modeling|March 11, 2015
Molecular dynamics study of the inhibitory effects of ChEMBL474807 on the enzymes GSK-3β and CDK-2Przemysław Czeleń, Beata SzeflerPageof 694