ArtemisDiscovery provides tools and custom development for computer-aided drug design, molecular simulation, cheminformatics and computational biology
We offer the novel CONDUCTOR* method that provides a physically-complete representation of aqueous solvent using the continuum approach, and the python package arFF for molecular simulation and docking using this efficient and powerful approach to solvation
Contact us with questions, and open the Intro tab for a tutorial introduction and examples
* CONDUCTOR, a fast, efficient and robust tool for continuum solvation computations for macromolecules
R. Zauhar & A. Juffer,
DOI:10.26434/chemrxiv-2024-c8ttb