openbabel-gui binary package in Ubuntu Jammy amd64
Open Babel is a chemical toolbox designed to speak the many languages of
chemical data. It allows one to search, convert, analyze, or store data from
molecular modeling, chemistry, solid-state materials, biochemistry, or related
areas. Features include:
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* Hydrogen addition and deletion
* Support for Molecular Mechanics
* Support for SMARTS molecular matching syntax
* Automatic feature perception (rings, bonds, hybridization, aromaticity)
* Flexible atom typer and perception of multiple bonds from atomic coordinates
* Gasteiger-Marsili partial charge calculation
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File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL
Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.
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This package contains the openbabel GUI based on wxWidgets.
Publishing history
Date | Status | Target | Component | Section | Priority | Phased updates | Version | ||
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2022-03-02 17:45:17 UTC | Published | Ubuntu Jammy amd64 | release | universe | science | Optional | 3.1.1+dfsg-6ubuntu5 | ||
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Deleted | Ubuntu Jammy amd64 | proposed | universe | science | Optional | 3.1.1+dfsg-6ubuntu5 | |||
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2022-02-07 08:54:39 UTC | Superseded | Ubuntu Jammy amd64 | proposed | universe | science | Optional | 3.1.1+dfsg-6ubuntu4 | ||
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2022-01-18 08:28:53 UTC | Superseded | Ubuntu Jammy amd64 | proposed | universe | science | Optional | 3.1.1+dfsg-6ubuntu3 | ||
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2022-01-17 20:49:16 UTC | Superseded | Ubuntu Jammy amd64 | proposed | universe | science | Optional | 3.1.1+dfsg-6ubuntu2 | ||
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2022-03-02 18:00:59 UTC | Superseded | Ubuntu Jammy amd64 | release | universe | science | Optional | 3.1.1+dfsg-6ubuntu1 | ||
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