all options
wheezy  ] [  jessie  ] [  stretch  ] [  sid  ]
[ Source: indigo  ]

Package: indigo-utils (1.0.0-2)

Links for indigo-utils

Screenshot

Debian Resources:

Download Source Package indigo:

Maintainers:

External Resources:

Similar packages:

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
 * indigo-cano
 * indigo-deco
 * chemdiff

Other Packages Related to indigo-utils

  • depends
  • recommends
  • suggests
  • enhances

Download indigo-utils

Download for all available architectures
Architecture Package Size Installed Size Files
sparc 30.3 kB113.0 kB [list of files]