AMBER Archive (2000)

Subject: problems with MD

From: user1 (user1_at_qsar.scfarm.unibo.it)
Date: Wed Mar 01 2000 - 08:27:10 CST


I'm running MD on the active site of my protein. After 120 ps (file of 50 ps)
when I restart the calculations, the program doesn't run and this message
appears:

qsar1 10% fmt: read unexpected character
apparent state: unit 10 named provamd3.restrt
last format: (6F12.7)
Unit 10 is a sequential formatted external file
*** Execution Terminated (115) ***

As the input file is always the same, I don't understand this behaviour.

Cristina Dezi

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