Total results: 37
Code : csmol , cssdf , csrxn , csrdf. Extensions : .csmol , .cssdf , .csrxn , .csrdf. Using the MdlCompressor class in Java. The chemaxon.formats.MdlCompressor ...
Converts the molecule to the specified text format (mol, csmol, smiles, ...) The following methods can be used to retrieve information on a structure ...
Molecule, csmol csrxn cssdf csrdf. Chemaxon, Chemaxon Extended SMILES, Molecule, cxsmiles. Chemaxon, Chemaxon Extended SMARTS, Molecule, cxsmarts. Chemaxon ...
Default file format: mol , csmol , smiles , cxsmiles , cml , pdb , pov , sybyl , or xyz . mol. shortcuts, Specifies an alternative shortcut customization file ...
(Use an editable parameter to forbid the editing of the molecules.) true. molFormat, Default file format: mol , csmol , smiles , cxsmiles ...
Codename, Default value, Explanation. ocrCorrection, off, enable the conversion of names containing typical OCR (optical character recognition) errors.
Conversion to molecule formats ... format = mrv, mol, rgf, sdf, rdf, csmol, csrgf, cssdf, csrdf, cml, smiles, cxsmiles, abbrevgroup, sybyl, mol2, pdb, xyz, inchi, ...
format = mrv, mol, rgf, sdf, rdf, csmol, csrgf, cssdf, csrdf, cml, smiles, cxsmiles, abbrevgroup, sybyl, mol2, pdb, xyz, inchi, or name; the output options ...
MDL Molfiles and SDfiles can be stored in compressed Molfile (csmol) form; the uncompressed form is stored by default. See Setting options in the ...
Deuterium and tritium isotopes were converted to simple hydrogen atom if a molecule was exported to Chemaxon compressed MOL format (CSMOL). SMILES/SMARTS.