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conda-forge / packages / qcengine

A wrapper for Quantum Chemistry engines that adheres to the MolSSI (molssi.org) QCSchema.

copied from cf-post-staging / qcengine

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Type Size Name Uploaded Downloads Labels
conda 134.2 kB | noarch/qcengine-0.15.0-py_0.tar.bz2  5 years and 8 months ago 6008 main
conda 107.0 kB | noarch/qcengine-0.14.0-py_0.tar.bz2  6 years and 22 days ago 8551 main cf202003
conda 102.4 kB | noarch/qcengine-0.13.0-py_0.tar.bz2  6 years and 2 months ago 4701 main cf202003
conda 92.8 kB | noarch/qcengine-0.12.0-py_0.tar.bz2  6 years and 3 months ago 4502 main cf202003
conda 81.5 kB | noarch/qcengine-0.11.0-py_0.tar.bz2  6 years and 4 months ago 5032 main cf202003
conda 77.0 kB | noarch/qcengine-0.10.0-py_0.tar.bz2  6 years and 6 months ago 4987 main cf202003
conda 72.5 kB | noarch/qcengine-0.9.0-py_0.tar.bz2  6 years and 6 months ago 4789 main cf202003
conda 71.2 kB | noarch/qcengine-0.8.2-py_0.tar.bz2  6 years and 7 months ago 5112 main cf202003
conda 71.2 kB | noarch/qcengine-0.8.1-py_0.tar.bz2  6 years and 7 months ago 4563 main cf202003
conda 70.9 kB | noarch/qcengine-0.8.0-py_0.tar.bz2  6 years and 7 months ago 4501 main cf202003
conda 63.4 kB | noarch/qcengine-0.7.1-py_0.tar.bz2  6 years and 8 months ago 5392 main cf202003
conda 55.4 kB | noarch/qcengine-0.7.0-py_0.tar.bz2  6 years and 8 months ago 4464 main cf202003
conda 41.3 kB | noarch/qcengine-0.6.4-py_0.tar.bz2  6 years and 11 months ago 6890 main cf202003
conda 41.3 kB | noarch/qcengine-0.6.3-py_0.tar.bz2  6 years and 11 months ago 4883 main cf202003
conda 39.5 kB | noarch/qcengine-0.6.2-py_0.tar.bz2  6 years and 11 months ago 5026 main cf202003
conda 38.2 kB | noarch/qcengine-0.6.1-py_0.tar.bz2  6 years and 11 months ago 5061 main cf202003
conda 38.1 kB | noarch/qcengine-0.6.0-py_0.tar.bz2  6 years and 11 months ago 4853 main cf202003
conda 18.9 kB | noarch/qcengine-0.5.2-py_0.tar.bz2  7 years and 8 days ago 4963 main cf202003
conda 18.2 kB | noarch/qcengine-0.5.1-py_1.tar.bz2  7 years and 1 month ago 5737 main cf202003
conda 16.7 kB | noarch/qcengine-0.5.1-py_0.tar.bz2  7 years and 1 month ago 4809 main cf202003
conda 16.6 kB | noarch/qcengine-0.5.0-py_0.tar.bz2  7 years and 1 month ago 4894 main cf202003
conda 13.9 kB | noarch/qcengine-0.4.0-py_0.tar.bz2  7 years and 2 months ago 5340 main cf202003 cf201901
conda 12.6 kB | noarch/qcengine-0.3.0-py_0.tar.bz2  7 years and 5 months ago 5402 main cf202003 gcc7 cf201901
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