-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1 Dear Michelle,
unless any of the HKL2000 log files list Rpim, ALL your options involve going back to obtaining umerged intensities. If you still have the x-files available, the easiest from my point of view is to use x2sad followed by sadabs and xprep. xprep has a menu entry to show Rpim. Having said that, the (non-)availability of sadabs is probably the bottle neck in this chain, I am afraid. Cheers, Tim On 09/05/2012 12:14 AM, Michelle Deaton wrote: > I am trying to obtain an Rpim (precision indicating merging > Rfactor) value for a dataset that I have already processed with > HKL2000/Scalepack and refined. Is there a straightforward way to > obtain this value from my data? From what I understand, most of my > options involve going back and obtaining unmerged intensities. I > am hoping there may be a way for me to avoid having to backtrack > that far, as this data is now very far along in the refinement > process. > > Thank you, Michelle Deaton > > University of Denver Department of Chemistry and Biochemistry > - -- - -- Dr Tim Gruene Institut fuer anorganische Chemie Tammannstr. 4 D-37077 Goettingen GPG Key ID = A46BEE1A -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.12 (GNU/Linux) Comment: Using GnuPG with Mozilla - http://enigmail.mozdev.org/ iD8DBQFQRwpnUxlJ7aRr7hoRAsdIAJ4qkETGL+eIdyu3v/jLdE5qTlA17wCg60Sn ezz/NHQXNakdUUKuBbqrs6g= =9gjj -----END PGP SIGNATURE-----
