Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
Comparative Analysis of Quantum-Mechanical and standard Single-Structure Protein-Ligand Scoring Functions with MD-Based Free Energy Calculations
, Authors:
Mehran Jalaie, Jindřich Fanfrlík, Adam Pecina, Martin Lepšík, Jan Řezáč
Version 1 posted 14 March 2025
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