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Journal of Molecular Graphics & Modelling|May 11, 2019
Phonon stability, electronic structure results, mechanical and thermodynamic properties of RbSbO3 and CsSbO3 perovskite oxides: Ab initio investigationSajad Ahmad Dar, Ramesh Sharma, Abhishek Kr MishraJournal of Molecular Graphics & Modelling|May 9, 2018
Molecular dynamics-based model of VEGF-A and its heparin interactionsUrszula Uciechowska-Kaczmarzyk, Sándor Babik, Ferenc Zsila, et al.Journal of Molecular Graphics & Modelling|August 14, 2018
The influence of residue in the position of 116 on the inhibitory potency of TH588 for MTH1Rui-Juan Niu, Qing-Chuan Zheng, Hong-Xing ZhangJournal of Molecular Graphics & Modelling|July 1, 2018
Targeting a hidden site on class A beta-lactamasesFatma Gizem Avci, Fatma Ece Altinisik, Ipek Karacan, et al.Journal of Molecular Graphics & Modelling|July 6, 2018
Molecular dynamics simulation of G-actin interacting with PAMAM dendrimersZhuang-Lin Shen, Wen-de Tian, Kang Chen, et al.Journal of Molecular Graphics & Modelling|July 6, 2018
Physical properties of cubic BaGeO3 perovskite at various pressure using first-principle calculations for energy renewable devicesN A Noor, Q Mahmood, M Hassan, et al.Journal of Molecular Graphics & Modelling|July 18, 2018
Molecular mechanism of D816X mutation-induced c-Kit activation and -mediated inhibitor resistance in gastrointestinal stromal tumorHaohai Jiang, Weiwei Shao, Yuanjin Wang, et al.Journal of Molecular Graphics & Modelling|October 21, 2021
DFT/TD-DFT study to decipher the fluoride induced ring opening process of spiropyranSiddhiben Kediya, Anu Manhas, Mohsin Y Lone, et al.Journal of Molecular Graphics & Modelling|October 29, 2021
Formulation design and mechanism study of hydrogel based on computational pharmaceutics theoriesXingxing Dai, Liping Chen, Yuyao Liao, et al.Journal of Molecular Graphics & Modelling|October 17, 2021
Molecular dynamic simulation studies of adsorption and diffusion behaviors of methanol and ethanol through ZSM-5 zeoliteZahra Keyvanloo, Ali Nakhaei Pour, Fatemeh Moosavi, et al.Pageof 400