[ Bron: indigo ]
Pakket: libindigo0d (1.2.3-3.1)
Verwijzigingen voor libindigo0d
Debian bronnen:
Het bronpakket indigo downloaden:
Beheerders:
Externe bronnen:
- Homepage [lifescience.opensource.epam.com]
Vergelijkbare pakketten:
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.
Andere aan libindigo0d gerelateerde pakketten
|
|
|
|
-
- dep: libc6 (>= 2.29)
- GNU C Bibliotheek: Gedeelde bibliotheken
Ook een virtueel pakket geboden door: libc6-udeb
-
- dep: libcairo2 (>= 1.6.0)
- Cairo 2D vector graphics library
-
- dep: libgcc-s1 (>= 3.0)
- GCC support bibliotheek
-
- dep: libstdc++6 (>= 5.2)
- GNU Standard C++ Library v3
-
- dep: libtinyxml2.6.2v5
- C++ XML parsing library
-
- dep: zlib1g (>= 1:1.1.4)
- compressiebibliotheek - programma's