22 Apr
2009
22 Apr
'09
12:38 a.m.
Most other things weere the same including the resolution cutoff used and the input mtz. But phenix tells me that the md5checksums dont match.
Sorry, that's unexpected. The cutoff doesn't matter. The checksum is computed on the input data, before the cutoff is applied. The checksum is just a safety guard to avoid accidents. If you are sure the test set has not changed, simply remove the remark with the checksum from the pdb file. Let me know if the problem happens again and I'll take a closer look. In that case I will need all the input files and the sequence of commands to reproduce the problem (including the command that wrote the pdb file with the checksum). Ralf