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diff --git a/debian/control b/debian/control new file mode 100644 index 0000000..4b5261b --- /dev/null +++ b/debian/control @@ -0,0 +1,58 @@ +Source: python-modelcif +#Testsuite: autopkgtest-pkg-python +Standards-Version: 4.7.2 +Maintainer: Debian Med Packaging Team <debian-med-packaging@lists.alioth.debian.org> +Uploaders: + Steffen Moeller <moeller@debian.org>, + Ben Webb <ben@salilab.org>, +Section: science +Priority: optional +Build-Depends: + debhelper-compat (= 13), + dh-sequence-python3, + python3-setuptools, + python3-all, + python3-ihm, +Vcs-Browser: https://salsa.debian.org/med-team/python-modelcif +Vcs-Git: https://salsa.debian.org/med-team/python-modelcif.git +Homepage: https://github.com/ihmwg/python-modelcif +Rules-Requires-Root: no + +Package: python3-modelcif +Section: python +Architecture: all +Depends: + ${python3:Depends}, + ${misc:Depends}, +Description: handles mmCIF and BinaryCIF files with ModelCIF extension + The macromolecular Crystallographic Information File format is a standard + for the representation and description of large molecular structures like + proteins and/or nucleic acids. + . + This package provides a mechanism to describe the generation of a + theoretical model (for example, via comparative or homology model) + a set of Python objects. This includes, if applicable + * the templates(s) used for the modeling; + * the alignment between the template(s) and target sequence; + * the protocol used to generate models, such as template search, + modeling, and model selection; + * the actual coordinates of output models; + * grouping of multiple models; + * quality scores for models and/or alignments. + . + Once created, this set of Python objects can be written to an + mmCIF file that is compliant with the ModelCIF extension to the + PDBx/mmCIF dictionary, suitable for deposition in a repository such as + ModelArchive. The files can be viewed in any regular PDBx mmCIF viewer, + such as UCSF ChimeraX (although most viewers to date will only show + the model coordinates, not the ModelCIF-specific metadata). + . + This package leverages functionality provided by the python-ihm + package, which functions similarly, building a Python hierarchy + and then reading/writing mmCIF files. (However, python-ihm is used + for integrative models, and reads or writes files compliant with the + integrative/hybrid modeling extension dictionary.) In particular, many + python-ihm classes and modules are used in this library, for example + the ihm.Grant and ihm.Citation classes for handling grant or citation + information, or the ihm.dictionary module for validating files against + the mmCIF dictionary itself. |
