CATEGORY
Input/Output
SOURCE
CDK
DESCRIPTION
Verify that the molecules are valid according to CDK
INPUTS
A dataset of molecules
OUTPUTS
A dataset of molecules
OPTIONS
Filter mode | How to filter results: INCLUDE_PASS , INCLUDE_FAIL , INCLUDE_ALL |
ADDITIONAL INFO
Verify that the structures are valid for Chemistry Development Kit. For info see the docs for the RDKit equivalent.