On Fri, 2021-06-04 at 18:45 +0000, CRAIG A BINGMAN wrote: > The "Check/Delete Water" function under “Validate" would be more useful to me > if it were possible to ignore hydrogen > atoms in the distance calculations. There seems to be no distance window that > works simultaneously for water O-O > distances, where riding hydrogens are almost never present, and water > O-protein distances, where the protein almost > always carries riding hydrogens. >
I managed to find a useful PDB file on an old laptop. The fix to ignore water hydrogen atoms has now been published and will be available in 0.9.6. Paul. ######################################################################## To unsubscribe from the COOT list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=COOT&A=1 This message was issued to members of www.jiscmail.ac.uk/COOT, a mailing list hosted by www.jiscmail.ac.uk, terms & conditions are available at https://www.jiscmail.ac.uk/policyandsecurity/
