On the topic of twin refinement, I think it would be useful to implement the input of multiple twin laws. Xtriage identified three twin laws, but I had to refine in Refmac5 because only one could be entered in Phenix.

Thanks,
Chris


On Wed, Jul 30, 2014 at 12:33 AM, Pavel Afonine <pafonine@lbl.gov> wrote:
In terms of actual implementation I have this in mind:

http://www.phenix-online.org/newsletter/CCN_2011_01.pdf

"Maximum likelihood refinement of twinned structures", page 29.

Of course that would not stop (me) from implementing better ideas should they arrive. However the paper mentioned above pictures a clear image of the problem that we are going to address.

Pavel



On 7/29/14, 12:30 PM, Chris Fage wrote:
Thank you, Randy, Nat, and Peter. I'll keep an eye out for that pub.

Best,
Chris


On Tue, Jul 29, 2014 at 7:59 AM, Randy Read <rjr27@cam.ac.uk> wrote:
Yes, we were hoping to make some generalisations and improvements before publishing this.  (Which we obviously haven’t gotten around to doing yet!)

Randy

-----
Randy J. Read
Department of Haematology, University of Cambridge
Cambridge Institute for Medical Research    Tel: +44 1223 336500
Wellcome Trust/MRC Building                         Fax: +44 1223 336827
Hills Road                                                            E-mail: rjr27@cam.ac.uk
Cambridge CB2 0XY, U.K.                               www-structmed.cimr.cam.ac.uk

On 29 Jul 2014, at 13:44, Nathaniel Echols <nechols@lbl.gov> wrote:

> On Mon, Jul 28, 2014 at 12:41 PM, Chris Fage <cdfage@gmail.com> wrote:
> Can anyone please direct me to a literature reference describing the maximum likelihood method for detection of twinning based on twin laws, as implemented in phenix.xtriage?
>
> If you mean the twin fraction estimation, the code doesn't have anything more helpful than this:
>
> Zwart, Read, Grosse-Kunstleve & Adams, to be published
>
> -Nat
> _______________________________________________
> phenixbb mailing list
> phenixbb@phenix-online.org
> http://phenix-online.org/mailman/listinfo/phenixbb




_______________________________________________
phenixbb mailing list
phenixbb@phenix-online.org
http://phenix-online.org/mailman/listinfo/phenixbb