[AMBER] How to change fillratio in mm_pbsa.pl

From: pxq <pangxueqintea.yahoo.com.cn>
Date: Thu, 12 Aug 2010 22:59:13 +0800

Hello everyone,

     When doing mm_pbsa.pl calculation I get the error report:
                                     PB Bomb in setgrd(): focusing grid too large 2
                                     reset fillratio to a larger number 2.000
     So how to change it? Thank you for your kind help

Xueqin



=============================================================================================================
Pang Xueqin
State Key Laboratory of Molecular Reaction Dynamics
Dalian Institute of Chemical Physics
Chinese Academy of Sciences.
Tel: 0411-84379352
Mobile: 15840973721
Fax: 0411-84675584
E-mail: pxq.dicp.ac.cn
http://english.dicp.cas.cn/
=============================================================================================================

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Received on Thu Aug 12 2010 - 08:30:07 PDT
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