On-the-fly free energy parameterization via temperature accelerated molecular dynamics

Document Details

Document Type
Pub Defense Publication
Publication Date
Sep 01, 2012
Source ID
10.1016/j.cplett.2012.07.064

Entities

People

  • Cameron F Abrams
  • Eric Vanden-Eijnden

Organizations

  • National Institutes of Health
  • National Science Foundation
  • Office of Naval Research