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Results 39 results

Title Keywords Workshop Files Additional Resources Product(s) Referenced
BACE1 Inhibitor Design Using Free Energy Perturbation FEP+, binding affinity, activity cliff, ligand preparation, rank ordering PDF Seminars FEP+
Library Design: Enumeration Tools library design, enumeration, R-group, bioisostere, reaction-based, pathfinder PDF Seminar Maestro
Rapid Screening of Chemical Libraries with GPU Shape Shape, GPU, library, enrichment PDF Shape Screening
Target Analysis with SiteMap and WaterMap WaterMap, SiteMap, target analysis PDF SiteMap WaterMap
Drug Development with Macrocycles Workshop Tutorial macrocycles, docking, Prime Sampling, ligand enumeration, FEP+ PDF Seminars Prime
Liability Analysis for Biologics liability, residue mutation, aggregation, solubility PDF Videos, Seminars BioLuminate
Building QSAR Models with AutoQSAR/DeepChem QSAR, DeepChem, Machine Learning, Mutagenicity, Ames PDF AutoQSAR
Structure-Based Virtual Screening Using Glide Workshop Tutorial molecular visualization, SBDD, virtual screening, docking HTML, PDF Videos, Seminars Glide
Introduction to Structure Visualization and Preparation Workshop Tutorial LBDD, molecular visualization, SBDD HTML, PDF Videos, Seminars Maestro
A Chemist's Guide to Maestro Workshop Tutorial SBDD, lead optimization, library design, molecular visualization, LBDD HTML, PDF Videos, Seminars Maestro