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[ Quellcode: indigo  ]

Paket: libindigo0d (1.2.3-3.1 und andere)

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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.

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Download für alle verfügbaren Architekturen
Architektur Version Paketgröße Größe (installiert) Dateien
amd64 1.2.3-3.1 2.304,4 kB7.349,0 kB [Liste der Dateien]
arm64 1.2.3-3.1+b1 1.961,0 kB7.381,0 kB [Liste der Dateien]
armel 1.2.3-3.1 1.853,1 kB6.202,0 kB [Liste der Dateien]
armhf 1.2.3-3.1 1.903,0 kB4.646,0 kB [Liste der Dateien]
i386 1.2.3-3.1 2.329,3 kB7.676,0 kB [Liste der Dateien]
mips64el 1.2.3-3.1 1.761,7 kB8.452,0 kB [Liste der Dateien]
ppc64el 1.2.3-3.1 2.170,4 kB8.726,0 kB [Liste der Dateien]
riscv64 1.2.3-3.1+b1 2.270,5 kB6.193,0 kB [Liste der Dateien]
s390x 1.2.3-3.1 1.980,6 kB7.218,0 kB [Liste der Dateien]