Liaison applies linear interaction approximation to accurately compute binding affinities for series of ligands with similar binding modes, making it a powerful tool for lead optimization.

LigPrep goes far beyond simple 2D to 3D structure conversions by including tautomeric, stereochemical, and ionization variations, as well as energy minimization and flexible filters to generate fully customized ligand libraries that are optimized for further computational analyses.

MacroModel combines leading force fields, accurate effective solvation models, and advanced conformational searching methods to provide the most complete molecular modeling package suitable for a wide array of research.

Maestro is the unified interface for all Schrödinger software. Impressive rendering capabilities, a powerful selection of analysis tools, and an easy-to-use design combine to make Maestro a versatile modeling environment for all researchers.

Maestro Elements was developed to facilitate communication and collaboration between modelers and chemists. Maestro Elements is fully compatible with Maestro, but is designed for medicinal chemists who need something that just “works.”