[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]

[ccp4bb]: Hi all,



***  For details on how to be removed from this list visit the  ***
***    CCP4 home page http://www.dl.ac.uk/CCP/CCP4/main.html    ***

I'm looking for a program that can calculate Fcalc's from a PDB file.  I
do NOT have the Fobs or any data.  I need to calculate the "Rmerge" 
between two sets of Fcalc's (each from independent PDB files).  Call it an
exercise.  SFALL needs an MTZ (and therefore data, which I don't have), so
what I need is some simple program that can calculate the Fcalc's.

Thanks in advance,

~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Jean-Philippe Cartailler
Dept. of Molecular Biology and Biochemistry
University of California, Irvine
Hudel Lab, http://anx12.bio.uci.edu/~hudel/

"The only existing things are the atoms and empty space; all else is mere
opinion." Democritus, 5th. century BC
	
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~