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Source: propka
Section: science
Priority: optional
Maintainer: Debian Med Packaging Team <debian-med-packaging@lists.alioth.debian.org>
Uploaders:
Andrius Merkys <merkys@debian.org>,
Build-Depends:
debhelper-compat (= 13),
dh-python,
dh-sequence-sphinxdoc,
help2man,
python3-all,
python3-numpy <!nocheck>,
python3-pytest <!nocheck>,
python3-setuptools,
python3-sphinx-rtd-theme,
Standards-Version: 4.7.0
Homepage: http://propka.org
Vcs-Browser: https://salsa.debian.org/med-team/propka
Vcs-Git: https://salsa.debian.org/med-team/propka.git
Testsuite: autopkgtest-pkg-pybuild
Rules-Requires-Root: no
Package: python-propka-doc
Architecture: all
Section: doc
Depends:
libjs-mathjax,
${misc:Depends},
${sphinxdoc:Depends},
Description: heuristic pKa calculations with ligands (documentation)
PROPKA predicts the pKa values of ionizable groups in proteins (version 3.0)
and protein-ligand complexes (version 3.1 and later) based on the 3D structure.
.
For proteins without ligands both versions should produce the same result.
.
This is the common documentation package.
Package: python3-propka
Architecture: all
Section: python
Depends:
${misc:Depends},
${python3:Depends},
Breaks:
pdb2pqr (<< 3.5.2),
Replaces:
pdb2pqr (<< 3.5.2),
Provides:
propka,
Suggests:
python-propka-doc,
Description: heuristic pKa calculations with ligands (Python 3)
PROPKA predicts the pKa values of ionizable groups in proteins (version 3.0)
and protein-ligand complexes (version 3.1 and later) based on the 3D structure.
.
For proteins without ligands both versions should produce the same result.
.
This package installs the library for Python 3.
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