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Contents of README:Avogadro Libraries is a subproject of Avogadro 2 as implementation of Avogadro 1.x mantained by OpenChemistry. It provides 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. Avogadro Libraries is a dependency required by the graphic interface user Avogadro Application (avogadroapp). This slackbuild requires as needed some dependencies (autodetected) that improve Avogadro Libraries. You can enable or disable them by passing variables to the script (e.g. VAR=yes|no ./avogadrolibs.SlackBuild): LIBMSYM=yes|no (default: yes, libmsym required) SPGLIB=yes|no (default: yes, spglib required) MMTF=yes|no (default: yes, mmtf-cpp required) HDF5=yes|no (default: no, hdf5 required) The extension Avogadro Generators (disabled by default) installs Python input generators that can be run by the Avogadro 2 application (avogadroapp) to generate input for various codes (Dalton, Q-Chem, Orca, NWChem, ecc.): these scripts will be installed in a location where the Avogadro 2 application can find them if the Plugin Downloader is executed from the graphic interface user. To enable the extension the dependency pybind11 is required and you have to pass the variable PYTHON=yes to the slackbuild script: PYTHON=yes ./avogadrolibs.SlackBuild |
Name Last modified Size
Parent Directory - README 03-Jun-2022 23:38 1.3K avogadrogenerators.tar.gz 03-Jun-2022 23:38 14K avogadrolibs-1.95.1.tar.gz 03-Jun-2022 23:38 11M avogadrolibs.SlackBuild 23-Apr-2022 20:52 4.4K avogadrolibs.info 03-Jun-2022 23:38 761 crystals-1.0.1.tar.gz 03-Jun-2022 23:38 148K fix_cmake-find-package.diff 03-Jun-2022 23:38 1.9K molecules-1.0.0.tar.gz 03-Jun-2022 23:38 202K slack-desc 03-Jun-2022 23:38 1.0K
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