Implementation of the QUBE Force Field in SOMD for High-Throughput Alchemical Free Energy Calculations (2021)

First Author: Cole D

Attributed to: Peta-5: A National Facility for Petascale Data Intensive Computation and Analytics funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.26434/chemrxiv.13116878

Publication URI: http://dx.doi.org/10.26434/chemrxiv.13116878

Type: Preprint