Computational Chemistry & Molecular Modeling Vendors
Computational design and modeling workflows used in discovery, including docking, virtual screening, molecular dynamics, QSAR, and structure-based drug design.
Related workflows
Software / Technology Platform · +4 more types
Simulations Plus is a drug-development software and consulting provider offering PBPK modeling, pharmacometrics and QSP, and AI-driven drug design.
Products: GastroPlus, MonolixSuite +9 more
Evidence-backed capability match
“ADMET Predictor provides a number of powerful cheminformatics solutions that support your design and lead optimization efforts, including the ability to conduct scaffold…”Source: simulations-plus.com
Also offers: Model-Informed Drug Development (MIDD), PBPK Modeling, +3 more