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Re: [ccp4bb]: Hi all,
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A program model_fcalc.inp in CNS can do this job.
On Thu, 7 Sep 2000, Jean-Philippe Cartailler wrote:
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> 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