[ Quellcode: indigo ]
Paket: libindigo0d (1.2.3-3.1)
Links für libindigo0d
Debian-Ressourcen:
Quellcode-Paket indigo herunterladen:
Betreuer:
Externe Ressourcen:
- Homepage [lifescience.opensource.epam.com]
Ähnliche Pakete:
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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libindigo0d herunterladen
| Architektur | Paketgröße | Größe (installiert) | Dateien |
|---|---|---|---|
| amd64 | 2.304,4 kB | 7.349,0 kB | [Liste der Dateien] |
| arm64 | 1.891,1 kB | 6.722,0 kB | [Liste der Dateien] |
| armel | 1.853,1 kB | 6.202,0 kB | [Liste der Dateien] |
| armhf | 1.903,0 kB | 4.646,0 kB | [Liste der Dateien] |
| i386 | 2.329,3 kB | 7.676,0 kB | [Liste der Dateien] |
| mips64el | 1.761,7 kB | 8.452,0 kB | [Liste der Dateien] |
| mipsel | 1.739,8 kB | 8.076,0 kB | [Liste der Dateien] |
| ppc64el | 2.170,4 kB | 8.726,0 kB | [Liste der Dateien] |
| s390x | 1.980,6 kB | 7.218,0 kB | [Liste der Dateien] |