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Package Details: rdkit-inchi 2023_03_1-1
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| Git Clone URL: | https://aur.archlinux.org/rdkit-inchi.git (read-only, click to copy) |
|---|---|
| Package Base: | rdkit-inchi |
| Description: | A collection of cheminformatics and machine-learning software written in C++ and Python. This version includes InChI support. |
| Upstream URL: | http://rdkit.org/ |
| Licenses: | BSD |
| Conflicts: | openbabel, rdkit, rdkit-git, rdkit-python2 |
| Provides: | rdkit |
| Submitter: | benjymack |
| Maintainer: | benjymack |
| Last Packager: | benjymack |
| Votes: | 0 |
| Popularity: | 0.000000 |
| First Submitted: | 2023-04-02 08:32 (UTC) |
| Last Updated: | 2023-05-05 22:25 (UTC) |
Dependencies (10)
- boost (boost-gitAUR)
- boost-libs
- cairo (cairo-gitAUR)
- eigen (eigen-gitAUR)
- python (python37AUR, python311AUR, python310AUR)
- python-cairocffi
- python-numpy (python-numpy-flameAUR, python-numpy-gitAUR, python-numpy1AUR, python-numpy-mkl-binAUR, python-numpy-mkl-tbbAUR, python-numpy-mklAUR)
- python-pillow
- sqlite (sqlite-fossilAUR)
- cmake (cmake-gitAUR) (make)
Required by (2)
- coot (requires rdkit)
- python-qcengine (requires rdkit) (optional)