AMBER Archive (2007)

Subject: Re: AMBER: binary restart file

From: Gustavo Seabra (gustavo.seabra_at_gmail.com)
Date: Fri Oct 05 2007 - 22:56:02 CDT


> Is the binary restart file (generated by ntxo=0) readable by ptraj?

NTXO=0 means to write an 'unformatted' restart file, but that doesn't
mean it is binary. To write binary trajectories, you need to specify
IOUTFM=1.

Have you tried to run your output from NTXO=0 through ptraj?

Gustavo.
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