About analyse csg_stat

[Dongze Wang]

Dear all,

I use csg_stat to provide correct intervals for distribution. My system has 5 beads ( number 1-5), according to the tutorials I write my setting files for different interactions but the output seems a little bit weird (see Plot, 2-2 means the non-bonded interactions between two type 2 bead). Here is the code for that: 

<cg>

  <non-bonded>

    <name>2-2</name>

    <type1>2</type1>

    <type2>2</type2>

    <min>1</min>

    <max>30</max>

    <step>0.5</step>

  </non-bonded>

   

</cg>

My question is: Is my script correct? And how to analyse this output plot to determine correct interval for force matching.

Thanks for your help.

Dongze 

[Christoph Junghans]

Looks ok to me! I would say 3.5 to 26 would be a good range, just pick
something above 0, so that the force matrix has some entries.

Christoph

>
> Dongze
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Christoph Junghans
Web: http://www.compphys.de