Dear Ethan,
thanks for comments. I do remember we talked about it last year in Argonne
at CCP4 school and we did not seem to agree indeed. Let me bring my
arguments as you stated yours.
Refinement is an optimization problem that involves model, data and fitting
tools (such as target function and
Dear CCP4ers,
many thanks to all of you who replied to my request!
I wish you a Merry Christmas and a Happy New Year!
Dirk.
Forwarded Message
Subject:[ccp4bb] Calculation of generalised R-factor?
Date: Tue, 20 Dec 2016 14:47:00 +0100
From: Dirk Kostrewa <ko
On Tuesday, 20 December 2016 10:28:44 PM Pavel Afonine wrote:
> Hi Dirk,
>
>
> I want to check the validity of the refinement of anisotropic B-factors vs.
> > TLS + isototropic B-factors using the Hamilton R-value ratio test as
> > described in Ethan Merritt's paper "To B or not to B", Acta
Hi Dirk,
I want to check the validity of the refinement of anisotropic B-factors vs.
> TLS + isototropic B-factors using the Hamilton R-value ratio test as
> described in Ethan Merritt's paper "To B or not to B", Acta Cryst. D, Vol
> 68, pp 468. This test uses the generalised R-factors (assuming
uesday, December 20, 2016 15:46
> To: Robbie Joosten <robbie_joos...@hotmail.com>; CCP4BB
> <ccp4bb@jiscmail.ac.uk>
> Subject: Re: [ccp4bb] Calculation of generalised R-factor?
>
> Dear Robbie,
>
>
> thanks for your reply. According to the REFMAC5 manual, the
to:CCP4BB@JISCMAIL.AC.UK>
*Onderwerp: *Re: [ccp4bb] Calculation of generalised R-factor?
I'd be interested as well.
JPK
-Original Message-
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of
Dirk Kostrewa
Sent: Tuesday, December 20, 2016 8:47 AM
To: CCP4BB@JISCMAIL.A
program to do your own Hamilton test.
Cheers,
Robbie
Sent from my Windows 10 phone
Van: Keller, Jacob<mailto:kell...@janelia.hhmi.org>
Verzonden: dinsdag 20 december 2016 14:23
Aan: CCP4BB@JISCMAIL.AC.UK<mailto:CCP4BB@JISCMAIL.AC.UK>
Onderwerp: Re: [ccp4bb] Calculation of generali
I'd be interested as well.
JPK
-Original Message-
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of Dirk
Kostrewa
Sent: Tuesday, December 20, 2016 8:47 AM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] Calculation of generalised R-factor?
Dear CCP4ers,
I want to check
Dear CCP4ers,
I want to check the validity of the refinement of anisotropic B-factors
vs. TLS + isototropic B-factors using the Hamilton R-value ratio test as
described in Ethan Merritt's paper "To B or not to B", Acta Cryst. D,
Vol 68, pp 468. This test uses the generalised R-factors
