<h2>Raw Package Information</h2>
<pre class="literal-block">
Package: python3-rdkit
Source: rdkit
Version: 202209.3-1.pgdg22.04+1
Architecture: amd64
Maintainer: Debichem Team &lt;debichem-devel@lists.alioth.debian.org&gt;
Installed-Size: 31851
Depends: fonts-freefont-ttf, rdkit-data, python3 (&lt;&lt; 3.11), python3 (&gt;= 3.10~), python3-numpy (&gt;= 1:1.20.0), python3-numpy-abi9, python3:any, libboost-python1.74.0 (&gt;= 1.74.0), libboost-serialization1.74.0 (&gt;= 1.74.0), libc6 (&gt;= 2.34), libcairo2 (&gt;= 1.4.10), libcoordgen3 (&gt;= 3.0.0), libgcc-s1 (&gt;= 3.0), libmaeparser1 (&gt;= 1.2.4), libpython3.10 (&gt;= 3.10.0), librdkit1 (&gt;= 202209.3), libstdc++6 (&gt;= 11)
Suggests: rdkit-doc
Provides: python3.10-rdkit
Homepage: http://www.rdkit.org
Priority: optional
Section: python
Filename: pool/main/r/rdkit/python3-rdkit_202209.3-1.pgdg22.04+1_amd64.deb
Size: 4303364
SHA256: 0097a2edf688c2b8d8d3bb877eb79f545d9516893446dc6c5bc8df544331d0c8
SHA1: fc5c9506f1f5e96c8104ef037d12c65469c537e4
MD5sum: af2bede5369328e5e2936901e2fdc4ca
Description: Collection of cheminformatics and machine-learning software
 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.
Python-Version: 3.10


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