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Giancarlo Dessì
6aec6d2a31
academic/avogadroapp: Updated for version 1.97.0.
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2 jaren geleden | |
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| .. | ||
| README | 6aec6d2a31 academic/avogadroapp: Updated for version 1.97.0. | 2 jaren geleden |
| avogadroapp.SlackBuild | 6aec6d2a31 academic/avogadroapp: Updated for version 1.97.0. | 2 jaren geleden |
| avogadroapp.info | 6aec6d2a31 academic/avogadroapp: Updated for version 1.97.0. | 2 jaren geleden |
| doinst.sh | 2112fdb101 academic/avogadroapp: Added (graphic user interface of Avogadro 2) | 2 jaren geleden |
| slack-desc | 2112fdb101 academic/avogadroapp: Added (graphic user interface of Avogadro 2) | 2 jaren geleden |
README
Avogadro Application is the graphic user interface of Avogadro 2.
Avogadro is an advanced molecular editor designed for cross-platform
use in computational chemistry, molecular modeling, bioinformatics,
materials science, and related areas. It offers flexible rendering and
a powerful plugin architecture.
Managed by OpenChemistry, Avogadro 2 it is based on QT5 libraries and
it is a rewrite of the old Avogadro 1.x.
By default the script builds avogadroapp with shared libraries. If you
want to enable the building with static libraries, pass the variable
SHARED=no to the script:
SHARED=no ./avogadroapp.SlackBuild (hdf5 required)
Warning: the computational settings made through the Input Generator
require the MoleQueue server running to submit jobs to local
applications or remote HPC clusters.
OPTIONAL:
hdf5 for a static build.
Avogadro is an advanced molecular editor designed for cross-platform
use in computational chemistry, molecular modeling, bioinformatics,
materials science, and related areas. It offers flexible rendering and
a powerful plugin architecture.
Managed by OpenChemistry, Avogadro 2 it is based on QT5 libraries and
it is a rewrite of the old Avogadro 1.x.
By default the script builds avogadroapp with shared libraries. If you
want to enable the building with static libraries, pass the variable
SHARED=no to the script:
SHARED=no ./avogadroapp.SlackBuild (hdf5 required)
Warning: the computational settings made through the Input Generator
require the MoleQueue server running to submit jobs to local
applications or remote HPC clusters.
OPTIONAL:
hdf5 for a static build.