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#6693 05/17/05 01:51 AM
Joined: Jul 2004
Posts: 13
uma347 Offline OP
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Joined: Jul 2004
Posts: 13
Hello all,

I get this error when I try to read a psf generated from a previous run.My system has 63514 atoms. While I understand that it is a large no of atoms, I dont understand why charmm didnot complain when I wrote the psf file but does not let me read it again.

Thanks,
Uma

Joined: Feb 2004
Posts: 147
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Posts: 147
Most likely you can get rid of the error by compiling CHARMM for bigger systems (using "xxlarge" or maybe even "huge" as install.com parameter).

Nevertheless, could you please post in this forum (perhaps in the "Bug Rports and Fixes" section) the input file that you used to create this system so that we could try to reproduce your problem ?


Moderated by  lennart, rmv 

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