The MM2QM tool for combining docking, molecular dynamics, molecular mechanics, and quantum mechanics†
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Reference50 articles.
1. Protein-ligand docking: Current status and future challenges
2. Correction to “A Machine Learning-Based Method To Improve Docking Scoring Functions and Its Application to Drug Repurposing”
3. Computer-aided drug-discovery techniques that account for receptor flexibility
4. Assessing the Role of Polarization in Docking
5. Can we trust docking results? Evaluation of seven commonly used programs on PDBbind database
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