[ trixie ]
[ sid ]
[ Source: rdkit ]
Package: postgresql-17-rdkit (202503.1-4 and others)
Links for postgresql-17-rdkit
Debian Resources:
Download Source Package rdkit:
Maintainers:
External Resources:
- Homepage [www.rdkit.org]
Similar packages:
Cheminformatics and machine-learning software (PostgreSQL Cartridge)
RDKit is a Python/C++ based cheminformatics and machine-learning software environment. Features Include:
* Chemical reaction handling and transforms * Substructure searching with SMARTS * Canonical SMILES * Molecule-molecule alignment * Large number of molecular descriptors, including topological, compositional, EState, SlogP/SMR, VSA and Feature-map vectors * Fragmentation using RECAP rules * 2D coordinate generation and depiction, including constrained depiction * 3D coordinate generation using geometry embedding * UFF and MMFF94 forcefields * Chirality support, including calculation of (R/S) stereochemistry codes * 2D pharmacophore searching * Fingerprinting, including Daylight-like, atom pairs, topological torsions, Morgan algorithm and MACCS keys * Calculation of shape similarity * Multi-molecule maximum common substructure * Machine-learning via clustering and information theory algorithms * Gasteiger-Marsili partial charge calculation
File formats RDKit supports include MDL Mol, PDB, SDF, TDT, SMILES and RDKit binary format.
This package contains the PostgreSQL extension.
Other Packages Related to postgresql-17-rdkit
|
|
|
|
-
- dep: libc6 (>= 2.14) [amd64]
- GNU C könyvtár: megosztott könyvtárak
also a virtual package provided by libc6-udeb
- dep: libc6 (>= 2.17) [arm64, ppc64el]
- dep: libc6 (>= 2.27) [riscv64]
- dep: libc6 (>= 2.38) [sparc64]
- dep: libc6 (>= 2.4) [m68k, mips64el, ppc64]
- dep: libc6 (>= 2.41) [loong64]
-
- dep: libc6.1 (>= 2.1.3) [alpha]
- GNU C könyvtár: megosztott könyvtárak
also a virtual package provided by libc6.1-udeb
-
- dep: libgcc-s1 (>= 3.0) [not alpha, m68k, riscv64, sparc64]
- GCC támogató programkönyvtár
- dep: libgcc-s1 (>= 3.4) [alpha, riscv64, sparc64]
-
- dep: libgcc-s2 (>= 4.2.1) [m68k]
- GCC támogató programkönyvtár
-
- dep: librdkit1t64 (>= 202309.3) [sparc64]
- Collection of cheminformatics and machine-learning software (shared libraries)
- dep: librdkit1t64 (>= 202409.2) [m68k, ppc64]
- dep: librdkit1t64 (>= 202503.1) [not m68k, ppc64, sparc64]
-
- dep: libstdc++6 (>= 13.1)
- GNU Standard C++ Library v3
-
- dep: postgresql-17
- The World's Most Advanced Open Source Relational Database
Download postgresql-17-rdkit
| Architecture | Version | Package Size | Installed Size | Files |
|---|---|---|---|---|
| alpha (unofficial port) | 202503.1-4 | 242.2 kB | 667.0 kB | [list of files] |
| amd64 | 202503.1-4 | 244.6 kB | 590.0 kB | [list of files] |
| arm64 | 202503.1-4 | 237.6 kB | 598.0 kB | [list of files] |
| loong64 (unofficial port) | 202503.1-4 | 241.5 kB | 597.0 kB | [list of files] |
| m68k (unofficial port) | 202409.2-2 | 231.7 kB | 548.0 kB | [list of files] |
| mips64el | 202503.1-4 | 238.4 kB | 627.0 kB | [list of files] |
| ppc64 (unofficial port) | 202409.2-2 | 244.4 kB | 717.0 kB | [list of files] |
| ppc64el | 202503.1-4 | 248.3 kB | 662.0 kB | [list of files] |
| riscv64 | 202503.1-4 | 243.7 kB | 546.0 kB | [list of files] |
| sparc64 (unofficial port) | 202309.3-6 | 193.4 kB | 1,224.0 kB | [list of files] |