A Simple QM/MM Approach for Capturing Polarization Effects in Protein−Ligand Binding Free Energy Calculations

Authors

Keywords

Journal

Volume 115, Issue 17, Pages 4911-4926

Publisher

American Chemical Society (ACS)

Online

2011-04-09

DOI

10.1021/jp109054j

Discuss science. Find collaborators. Network.

Join a conversation

Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.

Get Started