openbabel 2.2.0-1 (lpia binary) in ubuntu intrepid
Openbabel is a GPL and C++ rewrite of the 'babel' program to convert the
various file formats used in chemical software. The command-line interface
is mostly identical to the old 'babel' executable and recognizes these
file formats among many others:
.
Alchemy, ChemDraw, CML, GAMESS, Gaussian, HyperChem, MDL Isis and Molfile,
MOPAC, MPQC, PDB, SMILES and XYZ.
.
Right now, openbabel is not a 100% replacement for babel as some file
formats and bond order prediction is not yet fully supported.
Details
- Package version:
- 2.2.0-1
- Status:
- Obsolete
- Component:
- universe
- Priority:
- Optional
Downloadable files
lpia build of openbabel 2.2.0-1 in ubuntu intrepid RELEASE produced
these files:
- openbabel_2.2.0-1_lpia.deb (108.6 KiB)