Re: [ccp4bb] How to feed local structures to BALBES?

2011-06-22 Thread Dr. F Long
Hi Ethan, You need to put the files of PDB format in your own database or library. The error message in get_structure*log shows that BALBES encountered problems when it started to read your files to prepare the template models. Thanks, Fei On Wed, 22 Jun 2011 10:26:26 -0700, Ethan Merritt

Re: [ccp4bb] balbes run

2011-04-28 Thread Dr. F Long
Sorry Ed, We will add that function to the server in a few days. Fei On Wed, 27 Apr 2011 13:49:17 -0400, Ed Pozharski epozh...@umaryland.edu wrote: Is there any way to download all of the files produced by a BALBES run on YSBL server at once (as opposed to going through every item

Re: [ccp4bb] Balbes 1.0.0. different results between WWW Server and Local instalation

2009-06-29 Thread Dr. F Long
Dear Victor, Thank you very much for telling us that. Although it is a little strange to me because the same set of the fortran programs and python scripts are used in both the webserver version and standalone version of BALBES (except one fortran program I will mention later), we try to find

[ccp4bb] BALBES jobs in queue

2009-06-28 Thread Dr. F Long
Dear BALBES users, Since Garib announced new release of BALBES on June 25, many of you have submitted the jobs to run BALBES via the YSBL web server. Our computer cluster, which supports web server, has soon reached the limit and been running with full loading since early June 26. Many of your

Re: [ccp4bb] new version of automatic molecular replacement system - BALBES

2009-06-26 Thread Dr. F Long
Dear BALBES users, Our web servers had a problem yesterday and now is working properly. But our cluster machine reaches its limit now. There are 23 users currently running BALBES jobs on the server and some of them submitted jobs twice using multiple space group candidate option, which means one

Re: [ccp4bb] CCP4 6.1.0 Balbes error

2009-06-11 Thread Dr. F Long
Dear Victor and Ronan, BALBES has a new version (1.0.0), with substantial changes in organization and functionality, implemented on the YORK web server very recently, you will expect to hear the announcement for that from Garib very soon. In the new version, the module 'subprocess' or 'popen2'

Re: [ccp4bb] Problem running BALBES

2009-01-29 Thread Dr. F Long
a solution when using just the known structure of Protein 2 as a model. Is there a way to accomplish this? Sincerely, Jesse On Wed, Jan 28, 2009 at 1:25 PM, Dr. F Long f...@ysbl.york.ac.uk wrote: Dear Jesse, In both cases, there are some log files under, e,g. Test/process_details

Re: [ccp4bb] problem about BALBES

2009-01-05 Thread Dr. F Long
年1月5日,周一, Dr. F Long f...@ysbl.york.ac.uk 写道: 发件人: Dr. F Long f...@ysbl.york.ac.uk 主题: Re: [ccp4bb] problem about BALBES 收件人: CCP4BB@JISCMAIL.AC.UK 日期: 2009,15,周一,3:09上午 Dear Xiang Liu, From the log file, it looks you use a version of Python that comes with CCP4 and the lib file