SHELX C/D/E: Difference between revisions

143 bytes added ,  14 January 2013
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Use for RIP: the beta-test SHELXE inserts HKLF 4 and END before the first negative peak when writing the revised substructure to the .hat file. Normally this is a good way of finding where the noise begins, but for RIP if you want to recycle the negative peaks these lines should be removed.
Use for RIP: the beta-test SHELXE inserts HKLF 4 and END before the first negative peak when writing the revised substructure to the .hat file. Normally this is a good way of finding where the noise begins, but for RIP if you want to recycle the negative peaks these lines should be removed.
Nice writeup from GMS, as of Jan 13, 2013: https://www.jiscmail.ac.uk/cgi-bin/webadmin?A2=ind1301&L=ccp4bb&F=&S=&X=160F8F2598F868FF2A&P=83871


=== how to find out if a molecular replacement solution is correct or wrong ===
=== how to find out if a molecular replacement solution is correct or wrong ===
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