AMBER Archive (2005)

Subject: AMBER: lib-4324 : UNRECOVERABLE library error

From: lv haiting (lhaiting_at_126.com)
Date: Wed Dec 21 2005 - 20:31:46 CST

Hello,
    Now I did a hydrogen minimize using amber7, the input file is the following:

 Control section
&cntrl
 ntpr = 5,
 cut = 10.0,
 ntb = 0,
 maxcyc = 5000,
 ncyc = 100,
 ntr = 1,
 imin = 1,
 restraint_wt=500,
 restraintmask='!@H=',
&end

    But the system always terminated the job abnormally, the error information is :

lib-4324 : UNRECOVERABLE library error

Encountered during a namelist READ from unit 5
Fortran unit 5 is connected to a sequential formatted text file: "minH.in"
IOT Trap
MPI: MPI_COMM_WORLD rank 0 has terminated without calling MPI_Finalize()
MPI: aborting job
MPI: Received signal 6

Thanks in advance for your help.
 
Best regards

กกกกกกกกกกกกกกกกlv haiting
กกกกกกกกกกกกกกกกlhaiting_at_126.com
กกกกกกกกกกกกกกกกกกกก2005-12-22
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