Pharmacophore from molecule

Generate pharmacophore from molecule by mapping atoms to pharmacophore points. The generate pharmacophore will not contain the alpha and normal information.

Options

Molecule column
Column with molecules in SDF/Mol format
Pharmacophore type 2 element mapping
Mapping of each pharmacophore type to an element.

Input Ports

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Table with the molecules

Output Ports

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Table with Molecule as pharmacophore as extra column

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