Incorporating filename using molconvert

ChemAxon fa971619eb

27-11-2010 10:35:02

It is possible to incorporate the name of the file when using molconvert to convert a set of structure files into a SDF?

e.g. molconvert sdf *.mol -o molecules.sdf

but somehow have the file name appear as a field of the SDF.

Thanks

Tim

ChemAxon 7c2d26e5cf

01-12-2010 14:51:52

No, you can not do it with MolConverter.

I recommend to use the MarvinBeans API to do that.

Import structures with MolImporter, add an SD field with the file name to each Molecule object then export it with MolExporter.