Research Enablement Services

Propel your drug discovery program with unrivaled technologies and expertise

Advance your drug discovery programs at specific stages by fully leveraging Schrödinger’s latest technologies at scale, in the hands of our team of computational experts.

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Access Schrödinger’s latest technologies, run at scale

Benefit from the expertise of our team of computational scientists

All licensing, computing, and service time included

Target Enablement

Unlock your program for rigorous structure-based design

Let us help you prepare your protein target of interest for prospective FEP+ free energy calculations. Start from experimental x-ray structures, or incomplete cryoEM or AlphaFold structures, with known SAR. Schrödinger scientists leverage our unique technologies and expertise to model and validate protein-ligand complexes for highly predictive structure-based design methods.


Hit Discovery

Find more diverse hits, faster with advanced virtual screening technologies

Kickstart your drug discovery program with extensively validated virtual screening and rescoring workflows that leverage Schrödinger’s latest technologies at scale. Screen commercial libraries >5 billion compounds (or >300 million for fragment screens) using both structure- and ligand-based approaches simultaneously, followed by unique rescoring technologies with unrivaled accuracy. Identify more and better potent hits while purchasing and testing fewer compounds.


Crystal Polymorph Prediction

De-risk drug formulation by identifying the most stable polymorph

Build confidence in your drug formulation by computationally predicting crystal structures and the corresponding energy landscapes. Proactively identify alternative possible low energy crystal structures and prevent disappearing polymorph in late stage development. Schrödinger’s team of experts will leverage cutting-edge computational workflows to identify the most stable crystal forms, starting from the 2D structures of the drug candidates, and provide thermodynamic stability ranking of different structures efficiently.


Watch the video to learn how Schrödinger scientists achieved success in recent case studies

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