Autodock: autotors
Dear autodock experts,
I got a problem to run "autotors" on some of my peptide
models (the conformation of the peptide might not be
realistic, but everyone was refined in molecular modeling
program). I got the following error message:
mol2flag = 0
hflag = 1
offset = 70
aflag = 1
bflag = 1
bnd format:94 records read in
unable to attach all pieces of bond data
Does anybody encountered a similar problem before? How to
solve it?
Thank you advance for any suggestions.
Have a nice weekend?
Sincerely,
Zhang
******************************
Xiao-Ping Zhang
Department of Biochemistry
Arrhenius Laboratories of Natural Sciences
Stockholm Universities
106 91 Stockholm
Sweden
Phone: 046-08-162472 /162582
Fax: 046-08-153679
e-mail: zhang-0at0-biokemi.su.se