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dev-python/equilibrator-cheminfo

Light adapter classes around Open Babel, RDKit, and ChemAxon for the functionality needed in eQulibrator.

Screenshots

  • equilibrator-cheminfo-0.15.0
    ~amd64 ~x86
    chemaxon development openbabel rdkit python_targets_python3_11 python_targets_python3_12 python_targets_python3_13 python_targets_python3_14

    View      Download      Browse     License: Apache-2.0   
    Overlay: pypi

USE Flags

chemaxon
* This flag is undocumented *
development
* This flag is undocumented *
openbabel
Global: Use sci-chemistry/openbabel for file conversions
rdkit
* This flag is undocumented *
python_targets_python3_11
* This flag is undocumented *
python_targets_python3_12
* This flag is undocumented *
python_targets_python3_13
* This flag is undocumented *
python_targets_python3_14
* This flag is undocumented *