Dear all, Just would love to know what else is out there in addition to ELBOW in Phenix?
My utility is to generate the .pdb and .cif files from a SMILES string that would allow me to do compound fitting and real-space refinement in coot, and then reciprocal refinement elsewhere (assuming I won't have access to Phenix). Any pointer is much appreciated! Sincerely, Jacob ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/webadmin?SUBED1=CCP4BB&A=1
