Dear rdkit mailing list readers, I'd like to read several molecules from a SD file (created with MOE). These molecules have already added H's and I'd like to keep them as they are (so not readd them in rdkit after reading). How can I do this with the SDMolSupplier...right now I get the impression that he reads everything but H's.
Thanks for a hint. Cheers Peter Schmidtke ------------------------------------------------------------------------------ Start uncovering the many advantages of virtual appliances and start using them to simplify application deployment and accelerate your shift to cloud computing. http://p.sf.net/sfu/novell-sfdev2dev _______________________________________________ Rdkit-discuss mailing list Rdkit-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
