Total results: 24
Code : csmol , cssdf , csrxn , csrdf. Extensions : .csmol , .cssdf , .csrxn , .csrdf. Using the MdlCompressor class in Java. The chemaxon.formats.MdlCompressor ...
Removes the Hydrogen atoms from the molecule. toFormat, Converts the molecule to the specified text format (mol, csmol, smiles, ...) The following methods ...
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 ...
Codename, Default value, Explanation. ocrCorrection, off, enable the conversion of names containing typical OCR (optical character recognition) errors.
mrv, mol, rgf, sdf, rdf, csmol, csrgf, cssdf, csrdf, cml, smiles, cxsmiles, abbrevgroup, sybyl, mol2, pdb, xyz, inchi, or name. Example: SELECT ...
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.
In this example, we use Marvin as a custom accessory component of a file chooser to provide a preview to molecule files.