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A Computer-Driven Approach to Discover Natural Product Leads for Methicillin-Resistant Staphylococcus aureus Infection Therapy
The risk of methicillin-resistant Staphylococcus aureus (MRSA) infection is increasing in both the...
Design Hub for early phase drug discovery
Drug discovery is an iterative process of hypothesis construction relying on observations and...
Potential of marine natural products against drug-resistant bacterial infections
Natural products have been a rich source of compounds with structural and chemical diversity for...
Novel anti-prostate cancer scaffold identified by the combination of in silico and cell-based assays targeting the PI3K-AKT-mTOR pathway
Phenotypic assays were performed in prostate cancer cell lines to describe the biological activity...
Integrated In Silico Fragment-Based Drug Design: Case Study with Allosteric Modulators on Metabotropic Glutamate Receptor 5
GPCR allosteric modulators target at the allosteric binding pockets of G proteincoupled receptors...
IDBS & ChemAxon's Webinar: Showcasing the Best of Cheminformatics & Biologics in Data Management
Today’s fast-moving research requires that researchers have rapid access to data, with the ability...
DeepTox: Toxicity Prediction using Deep Learning
The Tox21 Data Challenge has been the largest effort of the scientific community to compare...