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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

Filters
Type Size Name Uploaded Downloads Labels
conda 239.1 kB | noarch/qcengine-0.33.0-pyhd8ed1ab_0.conda  2 months and 1 day ago 11736 main
conda 238.5 kB | noarch/qcengine-0.32.0-pyhd8ed1ab_0.conda  4 months and 28 days ago 17682 main
conda 237.0 kB | noarch/qcengine-0.31.0-pyhd8ed1ab_0.conda  8 months and 14 days ago 24499 main
conda 235.2 kB | noarch/qcengine-0.30.0-pyhd8ed1ab_0.conda  1 year and 3 months ago 32589 main
conda 231.7 kB | noarch/qcengine-0.29.0-pyhd8ed1ab_1.conda  1 year and 3 months ago 2991 main
conda 231.1 kB | noarch/qcengine-0.29.0-pyhd8ed1ab_0.conda  1 year and 11 months ago 32229 main
conda 230.4 kB | noarch/qcengine-0.28.1-pyhd8ed1ab_1.conda  1 year and 11 months ago 2602 main
conda 231.0 kB | noarch/qcengine-0.28.1-pyhd8ed1ab_0.conda  2 years and 1 month ago 9935 main
conda 230.9 kB | noarch/qcengine-0.28.0-pyhd8ed1ab_0.conda  2 years and 1 month ago 1796 main
conda 228.8 kB | noarch/qcengine-0.27.0-pyhd8ed1ab_0.conda  2 years and 1 month ago 7466 main
conda 224.6 kB | noarch/qcengine-0.26.0-pyhd8ed1ab_0.conda  2 years and 10 months ago 39964 main
conda 227.5 kB | noarch/qcengine-0.25.0-pyhd8ed1ab_0.tar.bz2  2 years and 10 months ago 5291 main
conda 216.8 kB | noarch/qcengine-0.24.1-pyhd8ed1ab_0.tar.bz2  3 years and 1 month ago 19845 main
conda 204.3 kB | noarch/qcengine-0.24.0-pyhd8ed1ab_0.tar.bz2  3 years and 2 months ago 6555 main
conda 194.6 kB | noarch/qcengine-0.23.0-pyhd8ed1ab_0.tar.bz2  3 years and 6 months ago 18187 main
conda 194.5 kB | noarch/qcengine-0.22.0-pyhd8ed1ab_0.tar.bz2  3 years and 8 months ago 6508 main
conda 195.8 kB | noarch/qcengine-0.21.0-pyhd8ed1ab_0.tar.bz2  3 years and 10 months ago 6035 main
conda 193.7 kB | noarch/qcengine-0.20.1-pyhd8ed1ab_0.tar.bz2  3 years and 11 months ago 6886 main
conda 192.9 kB | noarch/qcengine-0.20.0-pyhd8ed1ab_0.tar.bz2  3 years and 11 months ago 2931 main
conda 159.3 kB | noarch/qcengine-0.19.0-pyhd8ed1ab_0.tar.bz2  4 years and 4 months ago 15185 main
conda 149.5 kB | noarch/qcengine-0.18.0-pyhd8ed1ab_0.tar.bz2  4 years and 7 months ago 11541 main
conda 141.2 kB | noarch/qcengine-0.17.0-py_0.tar.bz2  4 years and 11 months ago 15452 main
conda 139.6 kB | noarch/qcengine-0.16.0-py_0.tar.bz2  5 years and 1 month ago 6326 main
conda 134.2 kB | noarch/qcengine-0.15.0-py_0.tar.bz2  5 years and 3 months ago 5782 main
conda 107.0 kB | noarch/qcengine-0.14.0-py_0.tar.bz2  5 years and 7 months ago 8323 main cf202003
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