AMBER Archive (2006)

Subject: AMBER: amber9 Test Failer

From: kawamura_hiro_at_riken.jp
Date: Tue Aug 15 2006 - 07:21:49 CDT

Dear Users,

I compiled AMBER 9 on Red Hat 8 with Intel Conpiler 8.1 .
When I tested after compilation, following error happen.

$ make test.sander
==============================================================
cd amoeba_jac; ./Run.amoeba_jac
diffing amoeba_jac.mdout.save with amoeba_jac.mdout
possible FAILURE: check amoeba_jac.mdout.dif
==============================================================

$ catamoeba_jac.mdout.dif
206c206
< EKCMT = 0. VIRIAL = 0. VOLUME = 0.0013 

---
>  EKCMT  =         0.  VIRIAL  =         0.  VOLUME     =         0.0028

Is this not a problem?

Sincerely
H.Kawamura,

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