https://github.com/rwest/RMG-Py
Tip revision: eed950a389738e70894c25e1d8388bb20ef75947 authored by Chris B on 20 March 2024, 19:07:34 UTC
restrict newer versions of cclib
restrict newer versions of cclib
Tip revision: eed950a
| File | Mode | Size |
|---|---|---|
| .conda | ||
| .github | ||
| arkane | ||
| documentation | ||
| examples | ||
| ipython | ||
| rmgpy | ||
| scripts | ||
| test | ||
| .gitignore | -rw-r--r-- | 2.0 KB |
| Arkane.py | -rw-r--r-- | 3.2 KB |
| CITATIONS.bib | -rw-r--r-- | 2.5 KB |
| CODE_OF_CONDUCT.md | -rw-r--r-- | 3.1 KB |
| Dockerfile | -rw-r--r-- | 2.9 KB |
| LICENSE.txt | -rw-r--r-- | 1.1 KB |
| Makefile | -rw-r--r-- | 4.2 KB |
| README.md | -rw-r--r-- | 5.3 KB |
| environment.yml | -rw-r--r-- | 3.4 KB |
| pytest.ini | -rw-r--r-- | 1012 bytes |
| rmg.py | -rw-r--r-- | 4.9 KB |
| setup.py | -rw-r--r-- | 12.3 KB |
| utilities.py | -rw-r--r-- | 14.9 KB |
