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Molecular Informatics|August 4, 2016
Connecting Classical QSAR and LERE Analyses Using Modern Molecular Calculations, LERE-QSAR (VI): Hydrolysis of Substituted Hippuric Acid Phenyl Esters by TrypsinAkira Mashima, Masahiro Kurahashi, Katsunori Sasahara, et al.
Molecular Informatics|August 4, 2016
Cross-talk Between Host, Microbiome and Probiotics: A Systems Biology Approach for Analyzing the Effects of Probiotic Enterococcus faecium NCIMB 10415 in PigletsS O Twardziok, R Pieper, J R Aschenbach, et al.
Molecular Informatics|August 4, 2016
Theoretical Studies on Pyrazolo[3,4-d]pyrimidine Derivatives as Potent Dual c-Src/Abl Inhibitors Using 3D-QSAR and Docking ApproachesGuo Hua Zeng, Dan Qing Fang, Wen Juan Wu, et al.
Molecular Informatics|August 4, 2016
Identification of Aurora-A Inhibitors by Ligand and Structure-Based Virtual ScreeningMohammad Neaz Morshed
Molecular Informatics|August 4, 2016
Investigating and Predicting how Biology Changes Molecules and Their PropertiesJonathan D Tyzack, Robert C Glen
Molecular Informatics|August 4, 2016
Attractor Structures of Signaling Networks: Consequences of Different Conformational Barcode Dynamics and Their Relations to Network-Based Drug DesignKristóf Z Szalay, Ruth Nussinov, Peter Csermely
Molecular Informatics|August 4, 2016
Quantitative Structure-Activity Relationship Analysis and a Combined Ligand-Based/Structure-Based Virtual Screening Study for Glycogen Synthase Kinase-3Gang Fu, Sheng Liu, Xiaofei Nan, et al.
Molecular Informatics|May 12, 2020
Consistent Cell-selective Analog Series as Constellation Luminaries in Chemical SpaceJ Jesús Naveja, José L Medina-Franco
Molecular Informatics|May 12, 2020
CompoundDB4j: Integrated Drug Resource of Heterogeneous Chemical DatabasesVidhya Murali, Cassandra Königs, Sarvani Deekshitula, et al.
Molecular Informatics|July 29, 2016
Using Spherical Harmonic Surface Property Representations for Ligand-Based Virtual ScreeningVioleta I Pérez-Nueno, Vishwesh Venkatraman, Lazaros Mavridis, et al.
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