Showing results (1751-1760 of 6,957) with videos related to
Sort By:
Pageof 696
Journal of Molecular Modeling|March 13, 2016
N-H bond cleavage of ammonia on graphene-like B36 borophene: DFT studiesZahra Rostami, Hamed SoleymanabadiJournal of Molecular Modeling|March 13, 2016
Free energy calculation provides insight into the action mechanism of selective PARP-1 inhibitorRan CaoJournal of Molecular Modeling|March 15, 2016
Hydrogen bonded and stacked geometries of the temozolomide dimerOkuma Emile Kasende, Jules Tshishimbi Muya, Vincent de Paul N Nziko, et al.Journal of Molecular Modeling|June 23, 2016
Analyzing the substitution effect on the CoMFA results within the framework of density functional theory (DFT)Alejandro Morales-BayueloJournal of Molecular Modeling|June 22, 2016
Gibbs ensemble Monte Carlo simulation using an optimized potential model: pure acetic acid and a mixture of it with ethyleneMinhua Zhang, Lihang Chen, Huaming Yang, et al.Journal of Molecular Modeling|June 3, 2016
Computer-aided rational design of novel EBF analogues with an aromatic ringShanshan Wang, Yufeng Sun, Shaoqing Du, et al.Journal of Molecular Modeling|June 6, 2016
Molecular dynamics study of the behavior of nitromethanes enclosed inside carbon nanotube containersSe Won Bae, Soo Gyeong ChoJournal of Molecular Modeling|November 1, 2015
Substituent effects on the croconate dyes in dye sensitized solar cell applications: a density functional theory studyRamesh Kumar Chitumalla, Manho Lim, Xingfa Gao, et al.Journal of Molecular Modeling|November 5, 2015
Tuning of chalcogen bonds by cation-π interactions: cooperative and diminutive effectsMehdi D Esrafili, Nasibeh Saeidi, Mohammad SolimannejadJournal of Molecular Modeling|November 5, 2015
Theoretical study of the oxidation mechanisms of thiophene initiated by hydroxyl radicalsAbolfazl Shiroudi, Michael S DeleuzePageof 696