M. Fx

icon location Wrocław icon location Retro coding, 3D graphics, MS-DOS, Linux

Results 1 comments of M. Fx

Modify unit tests so they pass in RDKit 2021.09

Hi @rvianello! Thanks for your comment. I am using RDKit tag Release_2021_09_3, and I noticed that the default output from `mol_to_ctab ` is now in V3000 format, not V2000 as...