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Journal of Molecular Graphics & Modelling|July 26, 2017
Prediction of protein structural class for low-similarity sequences using Chou's pseudo amino acid composition and wavelet denoisingBin Yu, Lifeng Lou, Shan Li, et al.Journal of Molecular Graphics & Modelling|July 31, 2017
Computational approaches to understand the adverse drug effect on potassium, sodium and calcium channels for predicting TdP cardiac arrhythmiasMohsen SharifiJournal of Molecular Graphics & Modelling|August 2, 2017
In silico molecular docking studies of new potential 4-phthalazinyl-hydrazones on selected Trypanosoma cruzi and Leishmania enzyme targetsAngel H Romero, Simón E LópezJournal of Molecular Graphics & Modelling|June 6, 2016
Towards cheminformatics-based estimation of drug therapeutic index: Predicting the protective index of anticonvulsants using a new quantitative structure-index relationship approachShangying Chen, Peng Zhang, Xin Liu, et al.Journal of Molecular Graphics & Modelling|June 24, 2016
Efficacy of bi-component cocrystals and simple binary eutectics screening using heat of mixing estimated under super cooled conditionsPiotr CysewskiJournal of Molecular Graphics & Modelling|July 18, 2017
Wettability modification of Wender lignite by adsorption of dodecyl poly ethoxylated surfactants with different degree of ethoxylation: A molecular dynamics simulation studyLei Zhang, Bao Li, Yangchao Xia, et al.Journal of Molecular Graphics & Modelling|September 20, 2015
Thermal conductivity and heat transport properties of nitrogen-doped grapheneElaheh K Goharshadi, Sayyed Jalil MahdizadehJournal of Molecular Graphics & Modelling|November 19, 2015
In silico and in vitro screening to identify structurally diverse non-azole CYP51 inhibitors as potent antifungal agentAarti Singh, Sarvesh Kumar Paliwal, Mukta Sharma, et al.Journal of Molecular Graphics & Modelling|November 30, 2015
Highly predictive support vector machine (SVM) models for anthrax toxin lethal factor (LF) inhibitorsXia Zhang, Elizabeth Ambrose AminJournal of Molecular Graphics & Modelling|November 15, 2017
Natural products used as a chemical library for protein-protein interaction targeted drug discoveryXuemei Jin, Kyungro Lee, Nam Hee Kim, et al.Pageof 407