Convert chemical file format .

Recently I knew KCF file format. The format represents molecules as graph structure. And it is used in KEGG. KCF uses atom label and orientation, and bond information. RDKit or Openbabel can not convert sdf 2 kcf. Someone who want to convert sdf to kcf. KEGG site provide us API for file format conversion. ExampleContinue reading “Convert chemical file format .”