Paket: indigo-utils (1.2.3-3.1 och andra)

Länkar för indigo-utils

Debianresurser:

Hämta källkodspaketet indigo:

Ansvariga:

Debichem Team (QA-sida, E-postarkiv)
Michael Banck (QA-sida)

Externa resurser:

Hemsida [lifescience.opensource.epam.com]

Liknande paket:

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: Molecule and reaction rendering utility
 * indigo-cano: Canonical SMILES generator
 * indigo-deco: R-Group deconvolution utility
 * chemdiff: Visual comparison of two SDF or SMILES files (needs the JAVA
   libraries)

Andra paket besläktade med indigo-utils

beror

rekommenderar

föreslår

enhances

dep: libc6 (>= 2.17) [arm64, ppc64el]

GNU C-bibliotek: Delade bibliotek
också ett virtuellt paket som tillhandahålls av libc6-udeb

dep: libc6 (>= 2.34) [riscv64]

dep: libc6 (>= 2.7) [ej arm64, ppc64el, riscv64]
dep: libgcc-s1 (>= 3.5) [armel]

GCC stödbibliotek
dep: libindigo0d (>= 1.2.3)

Organic Chemistry Toolkit

rec: libindigo-java

Organic Chemistry Toolkit (Java package)

Hämta indigo-utils

Hämtningar för alla tillgängliga arkitekturer
Arkitektur	Version	Paketstorlek	Installerad storlek	Filer
amd64	1.2.3-3.1	34,8 kbyte	127,0 kbyte	[filförteckning]
arm64	1.2.3-3.1	34,2 kbyte	119,0 kbyte	[filförteckning]
armel	1.2.3-3.1	33,2 kbyte	108,0 kbyte	[filförteckning]
armhf	1.2.3-3.1	33,3 kbyte	104,0 kbyte	[filförteckning]
i386	1.2.3-3.1	35,7 kbyte	124,0 kbyte	[filförteckning]
mips64el	1.2.3-3.1	33,8 kbyte	117,0 kbyte	[filförteckning]
ppc64el	1.2.3-3.1	37,5 kbyte	259,0 kbyte	[filförteckning]
riscv64	1.2.3-3.1+b1	33,6 kbyte	114,0 kbyte	[filförteckning]
s390x	1.2.3-3.1	33,9 kbyte	115,0 kbyte	[filförteckning]