Published February 27, 2017
| Version 0.15.2
Software
Open
choderalab/yank: Health Report and Anisotropic Dispersion Control
Authors/Creators
- 1. Memorial Sloan-Kettering Cancer Center
- 2. @choderalab
Description
- Added simulation Health Report through a Jupyter Notebook with CLI support
- Added ability to control Anisotropic Dispersion Correction through YAML files
Files
choderalab/yank-0.15.2.zip
Files
(7.4 MB)
| Name | Size | Download all |
|---|---|---|
|
md5:0ce36f3a97386cd7ef54d1bcc88e7e3d
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7.4 MB | Preview Download |
Additional details
Related works
- Is supplement to
- https://github.com/choderalab/yank/tree/0.15.2 (URL)