telukir/pgchem_tigress
Pgchem::tigress is the chemoinformatics extension to the PostgreSQL DBMS. It enables PostgreSQL to handle molecules through SQL statements.
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Pgchem::tigress is the chemoinformatics extension to the PostgreSQL DBMS. It enables PostgreSQL to handle molecules through SQL statements.
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
:microscope::books: Galaxy Tool wrappers
Postgres contrib package with OpenBabel for Molecules, Substructures etc.