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Journal of Chemical Information and Modeling|February 3, 2022
Classification Model for the Second Extracellular Loop of Class A GPCRsAlessandro Nicoli, Andreas Dunkel, Toni Giorgino, et al.Journal of Chemical Information and Modeling|February 4, 2022
Deciphering the Mechanism of Binding Selectivity of Chlorofluoroacetamide-Based Covalent Inhibitors toward L858R/T790M Resistance MutationFarideh Badichi Akher, Abdolkarim Farrokhzadeh, Neil Ravenscroft, et al.Journal of Chemical Information and Modeling|October 20, 2021
C-Graphs Tool with Graphical User Interface to Dissect Conserved Hydrogen-Bond Networks: Applications to Visual RhodopsinsÉva Bertalan, Elena Lesca, Gebhard F X Schertler, et al.Journal of Chemical Information and Modeling|October 21, 2021
Cyclosporin A: Conformational Complexity and ChameleonicitySatoshi Ono, Matthew R Naylor, Chad E Townsend, et al.Journal of Chemical Information and Modeling|February 10, 2022
Estrogenic Activity of Tetrazole Derivatives Bearing Bisphenol Structures: Computational Studies, Synthesis, and In Vitro AssessmentUmesh B Gadgoli, Sunil Kumar Y C, Deepak Kumar, et al.Journal of Chemical Information and Modeling|February 14, 2022
iANP-EC: Identifying Anticancer Natural Products Using Ensemble Learning Incorporated with Evolutionary ComputationLoc Nguyen, Thanh-Hoang Nguyen Vo, Quang H Trinh, et al.Journal of Chemical Information and Modeling|February 14, 2022
Global Analysis of Heme Proteins Elucidates the Correlation between Heme Distortion and the Heme-Binding PocketHiroko X Kondo, Masanori Fujii, Takuma Tanioka, et al.Journal of Chemical Information and Modeling|February 24, 2022
Structure-Aware Multimodal Deep Learning for Drug-Protein Interaction PredictionPenglei Wang, Shuangjia Zheng, Yize Jiang, et al.Journal of Chemical Information and Modeling|February 23, 2022
Paired Simulations and Experimental Investigations into the Calcium-Dependent Conformation of AlbuminDharmeshkumar Patel, Stephanie L Haag, Jagdish Suresh Patel, et al.Journal of Chemical Information and Modeling|February 25, 2022
The Value of Peer Mentoring Networks for Developing Leaders and Inspiring ChangeChrystal D Bruce, Patricia M Flatt, Sarah R Kirk, et al.Pageof 909