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 have a meta-comment. Feature request (or bug requests) like this should give me as much information as possible. In this case an accession code, a residue or a specific atom where the problem occurs. Don't make me go scrabbling about looking for relevant PDB files. Somewhat relevant: https://pemsley.github.io/coot/blog/2020/09/21/how-to-make-a-bug-report.html > A check box that directs the program to ignore hydrogens in the distance > calculations would be very helpful. I think, at the moment, just ignore all hydrogen atom interactions. > > Thanks for a wonderful program that makes my professional life better and > more productive. > Thank you for your comment. 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/
