Re: [AMBER] PB Bomb in pb_atmlist(): maxnba too short

From: manikanthan bhavaraju <manikanthanbhavaraju.gmail.com>
Date: Tue, 1 Nov 2011 14:41:04 -0500

Found the pb_atmlist in the pb_list.f

where it says
if (eclose + pclose + sclose + nclose + cntr > maxnba) then
         write(6, '(4x,a,i8)') 'PB Bomb in pb_atmlist(): maxnba too short'
         call mexit(6, 1)



Didn't understood the meaning of eclose, pclose etc. Changed the values of
these variables, still getting the same error.


mani
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Received on Tue Nov 01 2011 - 13:00:03 PDT
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