Total results: 164
Tripos Mol2 format · Tripos SYBYL MOL format · XYZ format · Gaussian related file formats · Markush DARC format - VMN · CSV · Input and Output System · License ...
Tripos Mol2 import/export is alpha level in the current version of Marvin. Only the following records are imported and exported: @<TRIPOS>MOLECULE. @ ...
Basic export options · Compression and Encoding · Document formats · Graphics Formats · Molecule file conversion with Molconvert · Molecule Formats · CML · MDL ...
Molecule formats are able to store only chemically relevant information of the molecule. CML · CML Export Options · MDL MOL files · MDL MOLfiles, RGfiles, ...
Metal atoms are exported with their valence electrons into MDL mol format. Consequently, 1 or 2 implicit hydrogens are added to the alkali metals and alkaline ...
Tripos SYBYL MOL and MOL2 formats · XYZ format · Gaussian related file ... MOL V2000 files · Extended MOLfiles (V3000) · Reaction files (V2000) · Extended ...
The mol family of formats cannot store the implicit hydrogens of atoms, so it is calculated from the bond orders. This is always correct when the molecule is in ...
MarvinSketch and MarvinView can handle compressed molfiles that are typically five times smaller than their original, uncompressed version.
molconvert -2:2:F1,5,6 mol caffeine.mol. Copy. Import a file as XYZ, do not try to recognize the file format: molconvert smiles "foo.xyz{xyz:}". Copy. Note ...
FASTA file format · Protein Data Bank (PDB) file format · Tripos SYBYL MOL and MOL2 formats · XYZ format · Gaussian related file formats · Markush DARC format - ...