AMBER: PBSA error: PB bomb in pd_aaradi

From: Xin Hu <hux.mail.rockefeller.edu>
Date: Wed, 22 Jun 2005 10:34:13 -0400

Dear Amber user,
I had a problem with the PBSA calculations. The error showed:
PB bomb in pb_aaradi(): ZERO sigma found for non-hydrogen atom

I attached the prmtop file. Is there something worng with the parameters
(generated from leap)?

Thank you,



Xin






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Received on Wed Jun 22 2005 - 15:53:00 PDT