Dear Charles (and CCP4 users),
I was delighted to see that CCP4 update 057 at last includes Anna
Luebben's pdb2ins, which we had been requesting for months and is very
useful for preparing the two input files needed to run shelxl.
Unfortunately you were too modest to mention this in your email to the
group, so I am doing so here!
I should also mention that I was out of email contact for three days
recently because of hardware problems with the old shelx server that is
on its last legs and will not be fixed next time. Please use my new
email address gsheldr at uni-goettingen.de in future. The shelx homepage
moved to shelx.uni-goettingen.de over a year ago and was not affected.
Best wishes, George
On 10.05.2018 12:17, Charles Ballard wrote:
Dear All
This is out, and contains a fix to the nasty truncate bug detailed earlier (hat
tip to GPL), it is therefore
recommended that this be applied.
Also included are updates to
* aimless
* ccp4i2
* ccp4i
* gesamt
* mrbump
* dials interface
plus some workarounds for changes to web certificate handling (in ccp4.setup-sh
and ccp4.setup-csh). This
will need checking on your local installations as local changes may be lost.
Known issue:
Unfortunately, the changes to the setup files have broken the integration
between ARP/wARP and CCP4. This
can be recreated by re-running BINARY.setup. The next update will address this.
Charles
--
Prof. George M. Sheldrick FRS
Dept. Structural Chemistry,
University of Goettingen,
Tammannstr. 4,
D37077 Goettingen, Germany
Tel. +49-551-39-33021 or +49-5594-227312
