librdkit1_201903.1-2_i386.deb


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Description

librdkit1 - Collection of cheminformatics and machine-learning software (shared libraries)

Property Value
Distribution Debian Sid
Repository Debian Main i386
Package filename librdkit1_201903.1-2_i386.deb
Package name librdkit1
Package version 201903.1
Package release 2
Package architecture i386
Package type deb
Category libs role::shared-lib
Homepage http://www.rdkit.org
License -
Maintainer Debichem Team <debichem-devel@lists.alioth.debian.org>
Download size 2.95 MB
Installed size 12.95 MB

Alternatives

Package Version Architecture Repository
librdkit1_201903.1-2_amd64.deb 201903.1 amd64 Debian Main
librdkit1 - - -

Requires

Name Value
libboost-python1.67.0 -
libboost-serialization1.67.0 -
libc6 >= 2.4
libgcc1 >= 1:4.2
libpython3.7 >= 3.7.0
libschroedinger-coordgenlibs1 -
libschroedinger-maeparser1 -
libstdc++6 >= 9

Download

Type URL
Mirror ftp.br.debian.org
Binary Package librdkit1_201903.1-2_i386.deb
Source Package rdkit

Install Howto

  1. Update the package index:
    # sudo apt-get update
  2. Install librdkit1 deb package:
    # sudo apt-get install librdkit1

Files

Path
/usr/lib/libRDKitAlignment.so.1
/usr/lib/libRDKitAlignment.so.1.2019.03.1
/usr/lib/libRDKitCatalogs.so.1
/usr/lib/libRDKitCatalogs.so.1.2019.03.1
/usr/lib/libRDKitChemReactions.so.1
/usr/lib/libRDKitChemReactions.so.1.2019.03.1
/usr/lib/libRDKitChemTransforms.so.1
/usr/lib/libRDKitChemTransforms.so.1.2019.03.1
/usr/lib/libRDKitChemicalFeatures.so.1
/usr/lib/libRDKitChemicalFeatures.so.1.2019.03.1
/usr/lib/libRDKitDataStructs.so.1
/usr/lib/libRDKitDataStructs.so.1.2019.03.1
/usr/lib/libRDKitDepictor.so.1
/usr/lib/libRDKitDepictor.so.1.2019.03.1
/usr/lib/libRDKitDescriptors.so.1
/usr/lib/libRDKitDescriptors.so.1.2019.03.1
/usr/lib/libRDKitDistGeomHelpers.so.1
/usr/lib/libRDKitDistGeomHelpers.so.1.2019.03.1
/usr/lib/libRDKitDistGeometry.so.1
/usr/lib/libRDKitDistGeometry.so.1.2019.03.1
/usr/lib/libRDKitEigenSolvers.so.1
/usr/lib/libRDKitEigenSolvers.so.1.2019.03.1
/usr/lib/libRDKitFMCS.so.1
/usr/lib/libRDKitFMCS.so.1.2019.03.1
/usr/lib/libRDKitFileParsers.so.1
/usr/lib/libRDKitFileParsers.so.1.2019.03.1
/usr/lib/libRDKitFilterCatalog.so.1
/usr/lib/libRDKitFilterCatalog.so.1.2019.03.1
/usr/lib/libRDKitFingerprints.so.1
/usr/lib/libRDKitFingerprints.so.1.2019.03.1
/usr/lib/libRDKitForceField.so.1
/usr/lib/libRDKitForceField.so.1.2019.03.1
/usr/lib/libRDKitForceFieldHelpers.so.1
/usr/lib/libRDKitForceFieldHelpers.so.1.2019.03.1
/usr/lib/libRDKitFragCatalog.so.1
/usr/lib/libRDKitFragCatalog.so.1.2019.03.1
/usr/lib/libRDKitGraphMol.so.1
/usr/lib/libRDKitGraphMol.so.1.2019.03.1
/usr/lib/libRDKitInfoTheory.so.1
/usr/lib/libRDKitInfoTheory.so.1.2019.03.1
/usr/lib/libRDKitMMPA.so.1
/usr/lib/libRDKitMMPA.so.1.2019.03.1
/usr/lib/libRDKitMolAlign.so.1
/usr/lib/libRDKitMolAlign.so.1.2019.03.1
/usr/lib/libRDKitMolCatalog.so.1
/usr/lib/libRDKitMolCatalog.so.1.2019.03.1
/usr/lib/libRDKitMolChemicalFeatures.so.1
/usr/lib/libRDKitMolChemicalFeatures.so.1.2019.03.1
/usr/lib/libRDKitMolDraw2D.so.1
/usr/lib/libRDKitMolDraw2D.so.1.2019.03.1
/usr/lib/libRDKitMolHash.so.1
/usr/lib/libRDKitMolHash.so.1.2019.03.1
/usr/lib/libRDKitMolInterchange.so.1
/usr/lib/libRDKitMolInterchange.so.1.2019.03.1
/usr/lib/libRDKitMolStandardize.so.1
/usr/lib/libRDKitMolStandardize.so.1.2019.03.1
/usr/lib/libRDKitMolTransforms.so.1
/usr/lib/libRDKitMolTransforms.so.1.2019.03.1
/usr/lib/libRDKitOptimizer.so.1
/usr/lib/libRDKitOptimizer.so.1.2019.03.1
/usr/lib/libRDKitPartialCharges.so.1
/usr/lib/libRDKitPartialCharges.so.1.2019.03.1
/usr/lib/libRDKitRDBoost.so.1
/usr/lib/libRDKitRDBoost.so.1.2019.03.1
/usr/lib/libRDKitRDGeneral.so.1
/usr/lib/libRDKitRDGeneral.so.1.2019.03.1
/usr/lib/libRDKitRDGeometryLib.so.1
/usr/lib/libRDKitRDGeometryLib.so.1.2019.03.1
/usr/lib/libRDKitRGroupDecomposition.so.1
/usr/lib/libRDKitRGroupDecomposition.so.1.2019.03.1
/usr/lib/libRDKitReducedGraphs.so.1
/usr/lib/libRDKitReducedGraphs.so.1.2019.03.1
/usr/lib/libRDKitSLNParse.so.1
/usr/lib/libRDKitSLNParse.so.1.2019.03.1
/usr/lib/libRDKitShapeHelpers.so.1
/usr/lib/libRDKitShapeHelpers.so.1.2019.03.1
/usr/lib/libRDKitSimDivPickers.so.1
/usr/lib/libRDKitSimDivPickers.so.1.2019.03.1
/usr/lib/libRDKitSmilesParse.so.1
/usr/lib/libRDKitSmilesParse.so.1.2019.03.1
/usr/lib/libRDKitStructChecker.so.1
/usr/lib/libRDKitStructChecker.so.1.2019.03.1
/usr/lib/libRDKitSubgraphs.so.1
/usr/lib/libRDKitSubgraphs.so.1.2019.03.1
/usr/lib/libRDKitSubstructLibrary.so.1
/usr/lib/libRDKitSubstructLibrary.so.1.2019.03.1
/usr/lib/libRDKitSubstructMatch.so.1
/usr/lib/libRDKitSubstructMatch.so.1.2019.03.1
/usr/lib/libRDKitTrajectory.so.1
/usr/lib/libRDKitTrajectory.so.1.2019.03.1
/usr/lib/libRDKithc.so.1
/usr/lib/libRDKithc.so.1.2019.03.1
/usr/share/doc/librdkit1/changelog.Debian.gz
/usr/share/doc/librdkit1/changelog.gz
/usr/share/doc/librdkit1/copyright
/usr/share/lintian/overrides/librdkit1

Changelog

2019-08-20 - Andrius Merkys <merkys@debian.org>
rdkit (201903.1-2) unstable; urgency=medium
* Team upload.
[ Daniel Leidert ]
* Add CI support
* Use salsa-ci.yml as CI config and fix gbp.conf
* Trigger rebuild
[ Andrius Merkys ]
* Removing build-dependency on no longer existing texlive-generic-extra
(Closes: #933210)
2019-07-23 - Michael Banck <mbanck@debian.org>
rdkit (201903.1-1) unstable; urgency=medium
* New upstream release.
* debian/copyright: Removed Files-Excluded, no longer needed. 
* debian/patches/NoDownloads.patch: Remove CoordGen-specific hunks and add
another CoordGen-specific hunk that drops the template.mae template
support.
* debian/patches/sphinx_imgconverter.patch: Updated.
* debian/patches/postgres_v11_support.patch: Removed, no longer needed.
* debian/patches/testcase_32bit_fix.patch: Likewise.
* debian/patches/fix_coordgen_include_path.patch: Likewise.
* debian/control.in (Build-Depends): Added libboost-iostreams-dev.
* debian/control.in (Build-Depends): Added versioned Depends on version 1.1-4
of libschroedinger-coordgenlibs-dev.
* debian/control.in (python-rdkit): Package removed.
* debian/control.in (Build-Depends): Removed python-dev, python-numpy,
python-pandas and python-pil.
* debian/rules: Removed python(2) support.
* debian/control.in (Build-Depends): Added versioned Depends on version 1.2-1
of libschroedinger-maeparser-dev.
* debian/control: Regenerated.
* debian/rules (override_dh_install): Remove pycache directory before
install.
2019-05-01 - Andrius Merkys <merkys@debian.org>
rdkit (201809.1+dfsg-7) unstable; urgency=medium
* Team upload.
[ Alexandre Mestiashvili ]
* Update d/control.in, add python3-rdkit package and python3 build-deps
(Closes: #919161)
* Update d/rules, enable hardening, build python2 and python3 bindings
* Remove debian/python-rdkit.install, install modules via d/rules
* Update d/control with pg_buildext updatecontrol
2019-01-31 - Michael Banck <mbanck@debian.org>
rdkit (201809.1+dfsg-6) unstable; urgency=medium
* debian/patches/fix_coordgen_include_path.patch: New patch, fixes the
include path for system-installed coordgen headers. 
2019-01-31 - Michael Banck <mbanck@debian.org>
rdkit (201809.1+dfsg-5) unstable; urgency=medium
* debian/patches/series: Reenabled and refreshed NoDownloads.patch (Closes:
#920986).
2019-01-26 - Michael Banck <mbanck@debian.org>
rdkit (201809.1+dfsg-4) unstable; urgency=medium
* debian/patches/postgres_Makefile_fixes.patch: Replace @RDKIT_PARALLEL_SAFE@
tag according to version.
* debian/control.in: Added libschroedinger-coordgenlibs-dev and
libschroedinger-maeparser-dev.
* debian/control: Regenerated.
* debian/rules (override_dh_auto_configure): Removed
-DRDK_BUILD_COORDGEN_SUPPORT=OFF and -RDK_BUILD_MOLINTERCHANGE_SUPPORT=OFF.
* debian/patches/disable_hanging_test.patch: Removed and replaced with ...
* debian/patches/testcase_32bit_fix.patch: ... this patch, taken from
upstream commit 3f3613c8.
2019-01-09 - Michael Banck <mbanck@debian.org>
rdkit (201809.1+dfsg-3) unstable; urgency=medium
* debian/control.in (Build-Depends): Removed python-epydoc (Closes: #881562).
* debian/control: Regenerated.
2019-01-09 - Michael Banck <mbanck@debian.org>
rdkit (201809.1+dfsg-2) unstable; urgency=medium
* debian/patches/catch2_header.patch: New patch, adds the catch2 headers from
https://github.com/catchorg/Catch2/ which are otherwise downloaded during
build.

See Also

Package Description
librdmacm-dev_24.0-2_i386.deb Development files for the librdmacm library
librdmacm1_24.0-2_i386.deb Library for managing RDMA connections
librdp-taxonomy-tree-java_1.2.0-3_all.deb taxonomy tree library from Ribosomal Database Project (RDP)
libre-dev_0.6.0-4_i386.deb generic library for real-time communications (development files)
libre-engine-re2-perl_0.13-4+b1_i386.deb RE2 regex engine
libre-ocaml-dev_1.7.3-2_i386.deb regular expression library for OCaml
libre0_0.6.0-4_i386.deb generic library for real-time communications with async IO support
libre2-5_20190901+dfsg-1_i386.deb efficient, principled regular expression library
libre2-dev_20190901+dfsg-1_i386.deb efficient, principled regular expression library, development kit
libreact-ocaml-dev_1.2.0-3+b1_i386.deb functional reactive programming in OCaml
libreact-ocaml_1.2.0-3+b1_i386.deb functional reactive programming in OCaml (plugins)
libreactive-streams-java_1.0.2-1_all.deb Standard for asynchronous stream processing with non-blocking backpressure
libreactivedata-ocaml-dev_0.1-3+b1_i386.deb FRP with incremental changes in data structures
libreactivedata-ocaml_0.1-3+b1_i386.deb FRP with incremental changes in data structures (runtime)
libreactor-core-java_2.0.8-1_all.deb Reactive Streams Specification Implementation
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