[phenixbb] Adding multiple conformers beyond 4
phillips at biochem.wisc.edu
Tue Sep 15 11:05:09 PDT 2009
Instead of 'abusing' the altlocs (one CAN think of this as alternative
locations of the whole chain) if you have a convenient better way, we
George N. Phillips, Jr., Ph.D.
Professor of Biochemistry and of
University of Wisconsin-Madison
433 Babcock Dr. Madison, Wi 53706
Phone/FAX (608) 263-6142
On Sep 15, 2009, at 12:22 PM, Pavel Afonine wrote:
> Hi Ben,
> to allow so I will have to slightly change the code... I went
> through the whole PDB and did not find any item that has more than 3
> or 4 conformers (at the moment of coding this). So that made my
> choice for that temporary limitation of max=4 conformers (putting
> aside a number of cases of abusing altlocs to mimic multiple models
> MODEL-ENDMDL). Unfortunately, nothing is so permanent as temporary,
> so we have 4 since that -:)
> May I ask you: why you need to have more than 4 conformers? If it is
> really a bottleneck and stops you from doing something important
> right now, I can go ahead and fix it.
> On 9/15/09 9:20 AM, Ben Mueller wrote:
>> I am a relatively new Phenix user and I am trying to see if it is
>> possible to push the number of conformers beyond 4. I tried to do
>> so, and I recieved the error message:
>> RuntimeError: Exceed maximum allowable number of conformers (=4).
>> Is there an easy (or difficult) way around this?
>> Thanks for your time,
>> Ben Mueller
>> Phillips Lab
>> Department of Biochemistry
>> University of Wisconsin - Madison
>> phenixbb mailing list
>> phenixbb at phenix-online.org
> phenixbb mailing list
> phenixbb at phenix-online.org
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the phenixbb