Published March 1, 2021
| Version 1.0.4
Software
Open
OpenChemistry/stempy: stempy 1.0.4
Authors/Creators
- 1. Kitware
- 2. Lawrence Berkeley National Laboratory
- 3. @Kitware
- 4. Brookhaven National Laboratory
- 5. @uchicago-cs
Description
This release improves electron counting with a new multi-pass approach the reduce memory usage and make it more amenable to parallelization.
Infrastructure and changes have been implemented to allow binary wheels to be built and pushed to the Python Package Index (PyPI). This allow stempy to be install using pip on Windows, Mac and Linux.
Files
OpenChemistry/stempy-1.0.4.zip
Files
(800.0 kB)
| Name | Size | Download all |
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md5:8511a95fe63d118ea001f59fb1ca971e
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800.0 kB | Preview Download |
Additional details
Related works
- Is supplement to
- https://github.com/OpenChemistry/stempy/tree/1.0.4 (URL)