Subject: ERR IN MD RUN!! From: A.Madhumalar (malar_at_mbu.iisc.ernet.in) Date: Sun Aug 19 2001 - 03:40:19 CDT
Dear amber users,
When i run equilibration Md run i am getting the following err COORDINATE RESETTING CANNOT BE ACCOMPLISHED, DEVIATION IS TOO LARGE NITER, NIT, LL, I AND J ARE : 0***** 34 88 90 Could anybody tell me where i am going wrong?
regards madhu
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