Skip to content
Sections
>> Trisquel >> Paquets >> nabia >> libdevel >> libindigo-dev
etiona  ] [  nabia  ] [  aramo  ]
[ Paquet source : indigo  ]

Paquet : libindigo-dev (1.2.3-3build1)

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.

Autres paquets associés à libindigo-dev

  • dépendances
  • recommandations
  • suggestions
  • dep: libindigo0d (= 1.2.3-3build1)
    Organic Chemistry Toolkit

Télécharger libindigo-dev

Télécharger pour toutes les architectures proposées
Architecture Taille du paquet Espace occupé une fois installé Fichiers
amd64 2 567,2 ko21967 ko [liste des fichiers]
armhf 2 314,9 ko12859 ko [liste des fichiers]