Re: [ccp4bb] xds crashes

2022-11-29 Thread ClAuS Flensburg
avast.com > >> > >> > >> > >>To unsubscribe from the CCP4BB list, click the following link: > >>https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 > >> > &g

Re: [ccp4bb] dictionary conversion

2017-06-30 Thread ClAuS Flensburg
Hi Paul, On Fri, Jun 30, 2017 at 02:00:14PM +0100, Paul Emsley wrote: > Hi, > > What is the best (or easiest) way to convert restraint information > (and in particular torsion restraint information) from the mmcif > output of privateer or acedrg to a dic file suitable for refinement > with Buster

Re: [ccp4bb] ccp4 version in sharp

2013-12-11 Thread ClAuS Flensburg
Dear Lisa, On Wed, Dec 11, 2013 at 07:48:24PM +0800, LISA wrote: > Hi all, > I tried to run autosharp and get the following error message about ccp4 > version. > > > *WARNING* : Your CCP4 [1 > ] > versi

Re: [ccp4bb] Problem running Buster (mtzdump: Cannot open environ.def)

2012-09-11 Thread Claus Flensburg
Dear Rosa, On Tue, Sep 11, 2012 at 04:51:44PM +0200, Rosa Grenha wrote: > Dear all > > I have been fighting to solve this problem in running buster and > would appreciate any advice on the subject (errors shown below). > > I have installed ccp4-6.3.0 and buster gives me now an error related > to

Re: [ccp4bb] Sftools can not handle non-standard settings?

2010-09-01 Thread Claus Flensburg
Dear Herman, please find attached a patch for sftools that will add support for the following non-standard space group settings: A2, C21, I21, P2122, P2212, P21221, P22121 Note: the number for I21 follows the upcomming change to syminfo.lib: 3004 -> 5005. diffstat -p0 < CCP4-20091104-src-sft

Re: [ccp4bb] purchasing heavy atom clusters

2009-09-09 Thread Claus Flensburg
Hi Engin, On Tue, Sep 08, 2009 at 04:06:20PM -0700, Engin Ozkan wrote: ... > On a related point, I would appreciate any pointers, especially on > software like shelx, sharp, solve, and mlphare, on treating clusters at > resolutions where the heavy atoms are not resolved (at 6A or worse). > U

Re: [ccp4bb] Logfile Problem on Dual-Core Intal Mac with Os X Server 10.4 and CCP4 6.0.1

2007-10-30 Thread Claus Flensburg
Hi Justin, On Mon, Oct 29, 2007 at 01:11:54PM +0100, Justin Schmitz wrote: > Hello All! > > I have a problem with the output there from CCP4 into the log files on a > dual-Core Intel Mac with Os X Server 10.4 and CCP4 6.0.1. > > > ATREF X ALL Y ALL Z ALL OCC ALL AOCC ALL B ALL > ATOM13 Ano