Hi,
A small bug report and the fix.
I've been trying to apply/change chain IDs using coot for a pdb
containing a series of models from a MD trajectory.
The pdb has been separated into individual models for individual chain
renaming.
For model 1, it works fine.
For model 2, coot crashes. -> changing model 2 for model 1 makes it
work again and fixes the problem.
the beginning of the pdb is like this:
REMARK GENERATED BY TRJCONV
TITLE PROTEIN t= 30000.00000 step= 7500000
REMARK THIS IS A SIMULATION BOX
CRYST1 102.787 98.059 152.041 90.00 90.00 90.00 P 1 1
MODEL 1
ATOM 1 N GLY 0 17.960 63.850 79.550 1.00 0.00
ATOM 2 H1 GLY 0 18.590 64.360 80.130 1.00 0.00
we are using coot 0.9.4, under wincoot standalone, or macOS downloaded
via CCP4. Both build create the same problem.
HTH
Vincent
--
Vincent Chaptal, PhD
Director of GdR APPICOM
Drug Resistance and Membrane Proteins Lab
MMSB -UMR5086
7 passage du Vercors
69007 LYON
FRANCE
+33 4 37 65 29 01
http://www.appicom.cnrs.fr
http://mmsb.cnrs.fr/en/
########################################################################
To unsubscribe from the COOT list, click the following link:
https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=COOT&A=1
This message was issued to members of www.jiscmail.ac.uk/COOT, a mailing list
hosted by www.jiscmail.ac.uk, terms & conditions are available at
https://www.jiscmail.ac.uk/policyandsecurity/
