https://github.com/mohebifar/pybel-orca

Python code around pybel to write inputs and read outputs of the ab initio package, ORCA
https://github.com/mohebifar/pybel-orca

Last synced: 12 days ago
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Python code around pybel to write inputs and read outputs of the ab initio package, ORCA

• Host: GitHub
• URL: https://github.com/mohebifar/pybel-orca
• Owner: mohebifar
• License: gpl-3.0
• Created: 2016-09-12T16:45:58.000Z (about 8 years ago)
• Default Branch: master
• Last Pushed: 2016-09-13T16:49:37.000Z (about 8 years ago)
• Last Synced: 2024-10-10T22:15:21.486Z (about 1 month ago)
• Language: Python
• Size: 17.6 KB
• Stars: 2
• Watchers: 2
• Forks: 0
• Open Issues: 0
• Metadata Files:
  • Readme: README.md
  • License: LICENSE

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# pybel-orca

Python code around pybel to write inputs and read outputs of the ab initio package, ORCA