There is a newer version of the record available.

Published October 13, 2016 | Version 0.11.2
Software Open

choderalab/yank: YANK 0.11.2

Authors/Creators

  • 1. Memorial Sloan-Kettering Cancer Center
  • 2. @choderalab

Description

This version adds better long range dispersion and electrostatic corrections.

Even better documentation to YAML files, including some best practices guidelines.

Files

choderalab/yank-0.11.2.zip

Files (21.3 MB)

Name Size Download all
md5:8415e3eaa52bef6cc760689a51de2087
21.3 MB Preview Download

Additional details

Related works

Is supplement to
https://github.com/choderalab/yank/tree/0.11.2 (URL)