Hi all,
reading this beauty I would like to ask a question to the respective
developers:
Will the PDB format remain the working format for the users and only
upon deposition will it be converted to PDBml for archiving purposes, or
are the refinement programs (et al.) going to abandon PDB, too?
Best,
Tim
On 10/04/2014 10:32 PM, Ed Pozharski wrote:
> grep "^ATOM " filename.pdb | cut -c 61-66 | awk '{s+=$1;} END {print s/NR;}'
>
> "Nobody likes a show off, Private"
> Skipper
>
> Cheers
>
>
> Sent on a Sprint Samsung Galaxy SŪ III
>
> <div>-------- Original message --------</div><div>From: Chen Zhao <[log in to unmask]> </div><div>Date:10/04/2014 4:03 PM (GMT-05:00) </div><div>To: PHENIX user mailing list <[log in to unmask]> </div><div>Subject: [phenixbb] Calculate average B-factor? </div><div>
> </div>Dear all,
>
> I am just wondering whether there is a command line tool in phenix that calculates the average B-factor of a PDB file? Can it deal with the ANISOU records (from TLS refinement or not) properly? I looked into previous posts but the --show-adp-statistics option in phenix.pdbtools seems to be no longer available in the version (1.9-1678) I installed.
>
> Thank you so much,
> Chen
>
>
>
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--
Dr Tim Gruene
Institut fuer anorganische Chemie
Tammannstr. 4
D-37077 Goettingen
GPG Key ID = A46BEE1A
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