[AMBER] error job.sh

From: MYRIAN TORRES RICO <myriam.torres.iiq.csic.es>
Date: Thu, 05 Mar 2020 18:05:40 +0100

Hi all,

When I launch my script, this error appears:

| APPROXIMATING direct energy using CUBIC SPLINE INTERPOLATION
| with 50.0 points per unit in tabled values
| Relative Error Limit not exceeded for r .gt. 2.47
| APPROXIMATING direct force using CUBIC SPLINE INTERPOLATION
| with 50.0 points per unit in tabled values
| Relative Error Limit not exceeded for r .gt. 2.90


any idea?


Thank in advance,


Myriam


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Received on Thu Mar 05 2020 - 09:30:02 PST