Hi all,
I've found that when adding hydrogens with pH correction using Python I get a segmentation
fault on the structure attached.
Hard to debug, since the code kills the interpreter, but the few tests I've done with
Begin/EndModify() do not make much difference.
Adding hydrogens with this code bit me several times already, so if anybody has advice on
how to prevent the crash or improve the code, it would be appreciated.
Thanks
S
--
Stefano Forli, PhD
Assistant Professor
Dept. of Integrative Structural
and Computational Biology, MB-112A
The Scripps Research Institute
10550 North Torrey Pines Road
La Jolla, CA 92037-1000, USA.
tel: +1 (858)784-2055
fax: +1 (858)784-2860
email: fo...@scripps.edu
http://www.scripps.edu/~forli/
segfault.pdb
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