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The Open Babel library and tools support import and export for a wide range of chemical file formats and data types. The following is an index to all formats, organized by the name of the format.
A List of extensions is also available, sorting formats by file extension.
Pages in category "Formats"
The following 98 pages are in this category, out of 98 total.
A
- Accelrys MSI text
- Accelrys/MSI BGF
- Accelrys/MSI Biosym/Insight II CAR
- Accelrys/MSI Quanta CSR
- ACR
- ADF Input
- ADF Output
- ADF Tape41
- Alchemy
- Amber Prep
- APBS PQR
B
C
- Cacao Cartesian
- Cacao Internal
- CAChe MolStruct
- Canonical SMILES
- CCC
- Chem3D Cartesian 1
- Chem3D Cartesian 2
- ChemDraw CDX
- ChemDraw CDXML
- ChemDraw Connection Table
- Chemical Markup Language
- Chemical Resource Kit 2D
- Chemical Resource Kit 3D
- Chemtool
- CML React
- Crystallographic Information File
- CSD CSSR
D
- DMol3 coordinates
- Dock 3.5 Box
F
- Fasta Sequence
- FastSearch
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F cont.
- Feature
- Fenske-Hall Z-Matrix
- Fingerprint (format)
- Free Form Fractional
G
- GAMESS Input
- GAMESS Output
- GAMESS UK Input
- GAMESS UK Output
- Gaussian 98/03 Cartesian Input
- Gaussian Cube
- Gaussian fchk
- Gaussian Z-matrix Input
- Gaussian98/03 Output
- Ghemical
- GROMOS96
H
I
J
- Jaguar input
- Jaguar output
M
- MacroModel
- MCDL
- MDL Molfile
- MDL RXN
- MmCIF
- Molden
- MOPAC Cartesian
- MOPAC Internal
- MOPAC Output
- MPQC output
- MPQC simplified input
- MSMS input
- Multilevel Neighborhoods of Atoms
N
|
N cont.
O
- Open Babel MolReport
- Open Babel report
- OpenDX grid
P
- Parallel Quantum Solutions
- PCModel
- PDB
- PNG (embedded)
- POV-Ray input
- PubChem
Q
- Q-Chem input
- Q-Chem output
R
S
- ShelX
- SMARTS
- SMILES
- SMILES FIX
- Sybyl descriptor
- Sybyl mol2
T
- Test
- Thermo
- Tinker XYZ
- Titles
- TurboMole Coordinate
U
V
X
Y
Z
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