indigo 1.2.3-3build1 source package in Ubuntu

Changelog

indigo (1.2.3-3build1) focal; urgency=medium

  * No-change rebuild for libgcc-s1 package name change.

 -- Matthias Klose <email address hidden>  Mon, 23 Mar 2020 07:16:28 +0100

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Uploaded by:
Matthias Klose on 2020-03-23
Uploaded to:
Focal
Original maintainer:
Debichem Team
Architectures:
any all
Section:
science
Urgency:
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Focal release on 2020-03-23 universe science

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File Size SHA-256 Checksum
indigo_1.2.3.orig.tar.gz 5.4 MiB 9b8f0f2a590a13b743500410fb8dfe6253b67b644945f48d888de29aeee5fccd
indigo_1.2.3-3build1.debian.tar.xz 21.1 KiB 495a4a4b33388f81e306ee870026ff02bfec20a235b314e057c7f562ab723d8b
indigo_1.2.3-3build1.dsc 2.3 KiB 2c56e954ef9784bab7f17b251c1e6ddf0f6311df8f1e29844cbbe02a8285b75a

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Binary packages built by this source

indigo-utils: Organic Chemistry Toolkit Utilities

 Indigo is a C++ based organic chemistry and cheminformatics software
 environment. Features Include:
 .
  * Molecule and reaction rendering including SVG support
  * Automatic layout for SMILES-represented molecules and reactions
  * Canonical (isomeric) SMILES computation
  * Exact matching, substructure matching, SMARTS matching
  * Matching of tautomers and resonance structures
  * Molecule fingerprinting, molecule similarity computation
  * Fast enumeration of SSSR rings, subtrees, and edge sugraphs
  * Molecular weight, molecular formula computation
  * R-Group deconvolution and scaffold detection
  * Computation of the exact maximum common substructure for an
    arbitrary amount of input structures
  * Combinatorial chemistry * Plugin support in the API
 .
 File formats Indigo support include MDL Mol, SDF, RDF, CML, SMILES and
 SMARTS.
 .
 This package contains the following utilities:
 .
  * indigo-depict: Molecule and reaction rendering utility
  * indigo-cano: Canonical SMILES generator
  * indigo-deco: R-Group deconvolution utility
  * chemdiff: Visual comparison of two SDF or SMILES files (needs the JAVA
    libraries)

indigo-utils-dbgsym: debug symbols for indigo-utils
libindigo-dev: Organic Chemistry Toolkit (development files)

 Indigo is a C++ based organic chemistry and cheminformatics software
 environment. Features Include:
 .
  * Molecule and reaction rendering including SVG support
  * Automatic layout for SMILES-represented molecules and reactions
  * Canonical (isomeric) SMILES computation
  * Exact matching, substructure matching, SMARTS matching
  * Matching of tautomers and resonance structures
  * Molecule fingerprinting, molecule similarity computation
  * Fast enumeration of SSSR rings, subtrees, and edge sugraphs
  * Molecular weight, molecular formula computation
  * R-Group deconvolution and scaffold detection
  * Computation of the exact maximum common substructure for an
    arbitrary amount of input structures
  * Combinatorial chemistry
  * Plugin support in the API
 .
 File formats Indigo support include MDL Mol, SDF, RDF, CML, SMILES and
 SMARTS.
 .
 This package contains the static library and header files.

libindigo-java: Organic Chemistry Toolkit (Java package)

 Indigo is a C++ based organic chemistry and cheminformatics software
 environment. Features Include:
 .
  * Molecule and reaction rendering including SVG support
  * Automatic layout for SMILES-represented molecules and reactions
  * Canonical (isomeric) SMILES computation
  * Exact matching, substructure matching, SMARTS matching
  * Matching of tautomers and resonance structures
  * Molecule fingerprinting, molecule similarity computation
  * Fast enumeration of SSSR rings, subtrees, and edge sugraphs
  * Molecular weight, molecular formula computation
  * R-Group deconvolution and scaffold detection
  * Computation of the exact maximum common substructure for an
    arbitrary amount of input structures
  * Combinatorial chemistry
  * Plugin support in the API
 .
 File formats Indigo support include MDL Mol, SDF, RDF, CML, SMILES and
 SMARTS.
 .
 This package contains the Java packages.

libindigo0d: Organic Chemistry Toolkit

 Indigo is a C++ based organic chemistry and cheminformatics software
 environment. Features Include:
 .
  * Molecule and reaction rendering including SVG support
  * Automatic layout for SMILES-represented molecules and reactions
  * Canonical (isomeric) SMILES computation
  * Exact matching, substructure matching, SMARTS matching
  * Matching of tautomers and resonance structures
  * Molecule fingerprinting, molecule similarity computation
  * Fast enumeration of SSSR rings, subtrees, and edge sugraphs
  * Molecular weight, molecular formula computation
  * R-Group deconvolution and scaffold detection
  * Computation of the exact maximum common substructure for an
    arbitrary amount of input structures
  * Combinatorial chemistry * Plugin support in the API
 .
 File formats Indigo support include MDL Mol, SDF, RDF, CML, SMILES and
 SMARTS.

libindigo0d-dbgsym: debug symbols for libindigo0d
python3-indigo: Organic Chemistry Toolkit (Python module)

 Indigo is a C++ based organic chemistry and cheminformatics software
 environment. Features Include:
 .
  * Molecule and reaction rendering including SVG support
  * Automatic layout for SMILES-represented molecules and reactions
  * Canonical (isomeric) SMILES computation
  * Exact matching, substructure matching, SMARTS matching
  * Matching of tautomers and resonance structures
  * Molecule fingerprinting, molecule similarity computation
  * Fast enumeration of SSSR rings, subtrees, and edge sugraphs
  * Molecular weight, molecular formula computation
  * R-Group deconvolution and scaffold detection
  * Computation of the exact maximum common substructure for an
    arbitrary amount of input structures
  * Combinatorial chemistry
  * Plugin support in the API
 .
 File formats Indigo support include MDL Mol, SDF, RDF, CML, SMILES and
 SMARTS.
 .
 This package contains the Python modules.