Structure

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Structure functions display an image of the result structure in the target cell. The main difference between Image and Structure functions is, that Structure functions could be reused as the input for other functions as well.

Functions providing structure notations in different formats are the following:

JCMolFormat

Converts structures to different formats.

Function arguments:

Molecule
Format: the exact names of available formats, which have to typed into "Format" field are described here:

http://www.chemaxon.com/marvin/help/applications/molconvert.html

JCCXSMILES

Returns ChemAxon extended SMILES strings of a molecule. Detailed description of this file format can be found here:

http://www.chemaxon.com/marvin/help/formats/cxsmiles-doc.html

JCSMILES

Returns SMILES strings of a molecule. Detailed description of this file format can be found here:

http://www.chemaxon.com/marvin/help/formats/smiles-doc.html


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