AMBER Archive (2005)

Subject: AMBER: How to read unformatted restart file in PTRAJ ?

From: JunJun Liu (ljjlp03_at_gmail.com)
Date: Wed Jun 29 2005 - 01:20:57 CDT

Dear Amber Users:

It seems ptraj can't read unformatted restart file. When ptraj execute
"trajin mol.rst", the following error message occurs:
----------------
readAmberRestart(): sscanf on atoms and time in restart file mol.rst failed
WARNING in ptrajSetupIO(): trajin pde2-bay.rst, cannot open file...
----------------

I want to know if ptraj can read in unformatted file, and how?

Best Regards!

Liu 

-- 
JunJun Liu

College of Chemistry
Central China Normal University
WuHan   430079
P.R. China
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