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Journal of Chemical Information and Modeling|May 26, 2021
RNA Backbone Torsion and Pseudotorsion Angle Prediction Using Dilated Convolutional Neural NetworksJaswinder Singh, Kuldip Paliwal, Jaspreet Singh, et al.Journal of Chemical Information and Modeling|April 12, 2022
Insights on Rigidity and Flexibility at the Global and Local Levels of Protein Structures and Their Roles in Homologous Psychrophilic, Mesophilic, and Thermophilic Proteins: A Computational StudySrikanta Sen, Munna SarkarJournal of Chemical Information and Modeling|April 14, 2022
Mechanistic Insights into Passive Membrane Permeability of Drug-like Molecules from a Weighted Ensemble of TrajectoriesShe Zhang, Jeff P Thompson, Junchao Xia, et al.Journal of Chemical Information and Modeling|June 1, 2017
Dimerization and Structural Stability of Amyloid Precursor Proteins Affected by the Membrane MicroenvironmentsFude Sun, Long Chen, Peng Wei, et al.Journal of Chemical Information and Modeling|September 14, 2016
Sequence-Based Prediction of Protein-Carbohydrate Binding Sites Using Support Vector MachinesGhazaleh Taherzadeh, Yaoqi Zhou, Alan Wee-Chung Liew, et al.Journal of Chemical Information and Modeling|June 2, 2017
Thermodynamic Characterization of Hydration Sites from Integral Equation-Derived Free Energy Densities: Application to Protein Binding Sites and Ligand SeriesStefan Güssregen, Hans Matter, Gerhard Hessler, et al.Journal of Chemical Information and Modeling|June 21, 2017
Molecular Modeling of the Interactions between Carborane-Containing Analogs of Indomethacin and Cyclooxygenase-2Menyhárt-Botond Sárosi, Wilma Neumann, Terry P Lybrand, et al.Journal of Chemical Information and Modeling|June 24, 2017
Underestimated Halogen Bonds Forming with Protein Backbone in Protein Data BankQian Zhang, Zhijian Xu, Jiye Shi, et al.Journal of Chemical Information and Modeling|June 13, 2017
Statistical Analysis, Investigation, and Prediction of the Water Positions in the Binding Sites of ProteinsWei Xiao, Zenghui He, Meijian Sun, et al.Journal of Chemical Information and Modeling|October 25, 2021
Synergistic Effects of Natural Compounds Toward Inhibition of SARS-CoV-2 3CL ProteaseAvinash Mishra, Wajihul Hasan Khan, Anurag S RathorePageof 909