On Thu, 14 Mar 2019 13:19:00 -0600 Phuong Chau <[email protected]> wrote:
> Could anyone tell me any possible solution to solve this problem? 1. Go to ligand expo search @ http://ligand-expo.rcsb.org/ld-search.html 2. Search for UNL and consider the topology of an "unknown ligand". The solution is to fiter your substances to ones that are actually known. -- Dmitri Maziuk <[email protected]> _______________________________________________ Rdkit-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
