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Journal of Molecular Modeling|June 16, 2018
Synthesis, characterization, and NMR studies of 1,2,3-triazolium ionic liquids: a good perspective regarding cytotoxicityNicolas Glanzmann, Arturene M L Carmo, Luciana M R Antinarelli, et al.Journal of Molecular Modeling|July 15, 2018
A quantitative tool to establish magic number clusters, ε3, applied in small silicon clusters, Si2-11Gabriel F S Fernandes, Francisco B C Machado, Luiz F A FerrãoJournal of Molecular Modeling|July 16, 2018
Electronic and optical properties of C24, C12X6Y6, and X12Y12 (X = B, Al and Y = N, P)Debolina Paul, Jyotirmoy Deb, Barnali Bhattacharya, et al.Journal of Molecular Modeling|July 16, 2018
Characterization of the interactions between coumarin-derivatives and acetylcholinesterase: Examination by NMR and docking simulationsNazish U Tanoli, Sheraz A K Tanoli, Antonio G Ferreira, et al.Journal of Molecular Modeling|July 20, 2018
Computational study of the NO, SO2, and NH3 adsorptions on fragments of 3N-graphene and Al/3N grapheneYao-Dong Song, Liang Wang, Qian-Ting WangJournal of Molecular Modeling|July 11, 2018
Theoretical study on host-guest interaction between pillar[4]arene and molecules or ionsChao Shen, Zhenyu Gong, Lei Gao, et al.Journal of Molecular Modeling|July 11, 2018
Electrical tree inhibition by SiO2/XLPE nanocomposites: insights from first-principles calculationsXiaonan Zheng, Yang Liu, Ya WangJournal of Molecular Modeling|June 21, 2018
Assessment of density prediction methods based on molecular surface electrostatic potentialAyushi Nirwan, Alka Devi, Vikas D GhuleJournal of Molecular Modeling|June 24, 2018
Computational studies of metal carbonyl complexes of 3[4-ethyl(phenly)imino][indoline-2-one] and 3[4-butyl(phenly)imino][indoline-2-one]Nursel Acar, Sevil ŞenerJournal of Molecular Modeling|June 26, 2018
Molecular dynamics simulations of a DMSO/water mixture using the AMBER force fieldSlawomir S Stachura, Chris J Malajczuk, Ricardo L ManceraPageof 694