Journal of Molecular Graphics and Modelling

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Interactions between pyrazole derived enantiomers and Chiralcel OJ: Prediction of enantiomer absolute configurations and elution order by molecular dynamics simulations
Journal of Molecular Graphics and Modelling - Tập 66 - Trang 123-132 - 2016
Guixiang Hu, Meilan Huang, Chengcai Luo, Qi Wang, Jian-Wei Zou
Effect of solvent model when probing protein dynamics with molecular dynamics
Journal of Molecular Graphics and Modelling - Tập 71 - Trang 80-87 - 2017
Samuel Genheden
Theoretical investigation of self-assembled donor–acceptor phthalocyanine complexes and their application in dye-sensitized solar cells
Journal of Molecular Graphics and Modelling - Tập 59 - Trang 100-106 - 2015
Lijuan Yu, Li Lin, Yuwen Liu, Renjie Li
Controlled supramolecular interactions for targeted release of Amiodarone drug through Graphyne to treat cardiovascular diseases: An in silico study
Journal of Molecular Graphics and Modelling - Tập 121 - Trang 108452 - 2023
Mehvish Perveen, N.M.A. Hadia, Asima Noreen, Rana Farhat Mehmood, Samia nasr, I.S. Yahia, Rasheed Ahmad Khera, Javed Iqbal
A bibliometric analysis of the Journal of Molecular Graphics and Modelling: An update
Journal of Molecular Graphics and Modelling - Tập 117 - Trang 108313 - 2022
Peter Willett
Molecular docking and dynamic simulation evaluation of Rohinitib — Cantharidin based novel HSF1 inhibitors for cancer therapy
Journal of Molecular Graphics and Modelling - Tập 61 - Trang 141-149 - 2015
Tarun Agarwal, Nithyanan Annamalai, Asif Khursheed, Tapas Kumar Maiti, Hasni Bin Arsad, Mohammed Haris Siddiqui
Methoxy triphenylamine hexaazatrinaphthylene based small molecules as donor material for photovoltaic applications
Journal of Molecular Graphics and Modelling - Tập 122 - Trang 108486 - 2023
Shehla Gul, Muhammad Ans, Shaimaa A.M. Abdelmohsen, Meznah M. Alanazi, Ismail Hossain, Javed Iqbal
Antiprotozoal QSAR modelling for trypanosomiasis (Chagas disease) based on thiosemicarbazone and thiazole derivatives
Journal of Molecular Graphics and Modelling - Tập 103 - Trang 107821 - 2021
Diana L. Nossa González, Jovanny A. Gómez Castaño, Wilson E. Rozo Núñez, Pablo R. Duchowicz
A DFT-based quantum theoretic QSAR study of aromatic and heterocyclic sulfonamides as carbonic anhydrase inhibitors against isozyme, CA-II
Journal of Molecular Graphics and Modelling - Tập 26 - Trang 701-708 - 2007
Erol Eroglu, Hasan Türkmen
Effect of SiC nano-size fillers on the aging resistance of XLPE insulation: A first-principles study
Journal of Molecular Graphics and Modelling - Tập 93 - Trang 107438 - 2019
Hui Zhang, Yang Liu, Xia Du, Xuan Wang, Xiaonan Zheng, Zesheng Li
Tổng số: 1,567   
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