Unable to calculate SMD for amber topology

From: Aashish Bhatt (aashish.ph16221_at_inst.ac.in)
Date: Fri Jan 10 2020 - 08:33:10 CST

Dear Sir/Ma'am

I have tried to run the SMD calculation following the "*Methods for
calculating Potentials of Mean Force"* tutorial.
We using an amber topology file for SMD run. My equilibration dynamics are
running fine but when I performed the SMD the system showed
segmentation fault.
Is there any different file system needed for amber topology for
running SMD.

Can you please help me to resolve this issue.

Best Regards


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