Published May 10, 2023
| Version 1.0.0b1
Software
Open
Auto-FOX
Authors/Creators
Description
A library for analyzing potential energy surfaces (PESs) and using the resulting PES descriptors for constructing forcefield parameters.
Notes
If you use this software, please cite it as below.
Files
nlesc-nano/auto-FOX-1.0.0b1.zip
Files
(125.8 MB)
| Name | Size | Download all |
|---|---|---|
|
md5:c1ac393475c798b329f5990093118581
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125.8 MB | Preview Download |
Additional details
Related works
- Is supplement to
- https://github.com/nlesc-nano/auto-FOX/tree/1.0.0b1 (URL)