CD73_inhibitors_SQM

Published: 21 October 2025| Version 2 | DOI: 10.17632/j4rbk4gnr4.2
Contributor:
Martin Lepsik

Description

Proteins (pdb files) and ligands (sdf files) from SQM2.20 optimized complexes are provided for the modeled 67 compounds.

Files

Steps to reproduce

See Methods of the paper.

Institutions

Ustav organicke chemie a biochemie Akademie ved Ceske republiky

Categories

Quantum Chemistry

Licence