Ecosyste.ms: Papers
An open API service providing mapping between scientific papers and software projects that are mentioned in them.
All mentions data is based on the CZI Software Mentions dataset.
Papers: 10.1021/acs.jctc.0c00634
https://doi.org/10.1021/acs.jctc.0c00634
Virtual Double-System Single-Box: A Nonequilibrium Alchemical Technique for Absolute Binding Free Energy Calculations: Application to Ligands of the SARS-CoV-2 Main Protease
Cited by: 26
Author(s): Marina Macchiagodena, Marco Pagliai, Maurice Karrenbrock, Guido Guarnieri, F. Iannone, Piero Procacci
Published: almost 4 years ago