# Profiling SARS-CoV-2 Main Protease (M<sup>PRO</sup>) Binding to Repurposed Drugs Using Molecular Dynamics Simulations in Classical and Neural Network-Trained Force Fields

> Research article (ACS Combinatorial Science, 2020) · cited 36× · AI/ML

**Wikidata**: [openalex:W3094648376](https://www.wikidata.org/wiki/openalex:W3094648376)  
**Source**: https://4ort.xyz/entity/profiling-sars-cov-2-main-protease-m-sup-pro-sup-binding-to-repurposed-drugs-using-molecular-dynamics-simulations-in-cla