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COUNTER VARIABLE HAS EXCEEDED ITS MAXIMUM ALLOWABLE VALUE
#15481 09/10/07 01:52 PM
Joined: Mar 2007
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jeffrey Offline OP
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Dear all,

When I solvated a protein complex with about 40,000 atoms, the CHARMM program crashed giving a hint:COUNTER VARIABLE HAS EXCEEDED ITS MAXIMUM ALLOWABLE VALUE. Only one variable displayed, NODON, has exceeded its maximum value MAXPAD=72000. I searched the forum, but couldn't get a clear fix method. So I try to modify the MAXPAD=140,000 in the dimens.fcm file and recompile it, and fixed the problem temporaly. Is it advisable to do so?

btw: I compiled CHARMM with huge version, so it is imposible to move up the size...

Any suggestion is appreciated.

Thanks.

-------------
Jeffrey

Re: COUNTER VARIABLE HAS EXCEEDED ITS MAXIMUM ALLOWABLE VALUE
jeffrey #15482 09/10/07 01:55 PM
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Yes that's OK.


Lennart Nilsson
Karolinska Institutet
Stockholm, Sweden

Moderated by  John Legato, lennart 

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