Dear AMber useres,
I want to simulate my model-protein, I wrote this input file but I am getting error that my
inout is not correct.Can maybe someone help to find the mistake or should i change something?
initial minimisation
&cntrl
imin = 1,
maxcyc = 500,
ncyc = 250,
ntb = 0,
ntr = 1,
ntpr = 10,
igb = 2,
cut = 12
/
Restrain the protein backbone atoms
10.0
RES 1-255.CA,C,A
END
END
thank you in advance
Best Regards,
Urszula Uciechowska
MSc.PhD Student
Medicinal Chemistry Group
University of Halle-Wittenberg
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Received on Wed Dec 12 2007 - 06:07:07 PST
