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Journal of Molecular Modeling|May 15, 2008
Mesoscopic simulation studies on micellar phases of Pluronic P103 solutionShouhong Yang, Xiuqing Zhang, Shiling YuanJournal of Molecular Modeling|May 28, 2008
A reexamination of the propensities of amino acids towards a particular secondary structure: classification of amino acids based on their chemical structureSasa N Malkov, Miodrag V Zivković, Milos V Beljanski, et al.Journal of Molecular Modeling|March 18, 2014
Full kinetics investigation of the formation reaction of phosphonate esters in the gas-phase: a theoretical studyMohammad Amin Kazemian, Sayyed Mostafa Habibi-Khorassani, Malek Taher Maghsoodlu, et al.Journal of Molecular Modeling|March 18, 2014
Recognition of 2',5'-linked oligoadenylates by human ribonuclease L: molecular dynamics studyKamil Maláč, Ivan BarvíkJournal of Molecular Modeling|March 18, 2014
Sumanene and its adsorption properties towards CO, CO₂ and NH₃ moleculesStevan Armaković, Sanja J Armaković, Jovan P Setrajčić, et al.Journal of Molecular Modeling|March 18, 2014
Multipolar electrostatics based on the Kriging machine learning method: an application to serineYongna Yuan, Matthew J L Mills, Paul L A PopelierJournal of Molecular Modeling|March 18, 2014
A quantum chemistry study of natural gas hydratesMert Atilhan, Nezih Pala, Santiago AparicioJournal of Molecular Modeling|March 18, 2014
A quantum chemistry study on thermochemical properties of high energy-density endothermic hydrocarbon fuel JP-10Xiao-Mei Qin, Hu-Jun Xie, Lei Yue, et al.Journal of Molecular Modeling|April 2, 2014
Novel hydrazine derivatives as selective DPP-IV inhibitors: findings from virtual screening and validation through molecular dynamics simulationsOmprakash Tanwar, Girdhar Singh Deora, Lalima Tanwar, et al.Journal of Molecular Modeling|April 3, 2014
Understanding the high reactivity of triazolinediones in Diels-Alder reactions. A DFT studyMaría A Fernández-Herrera, Claudia Zavala-Oseguera, José Luis Cabellos, et al.Pageof 695