[gmx-users] g_wham error

[Justin A. Lemkul]

mircial at sjtu.edu.cn wrote:

<snip>

> gunzip: stdin: not in gzip format
> 
> -------------------------------------------------------
> Program g_wham, VERSION 3.3.3
> Source code file: gmx_wham.c, line: 89
> 
> Fatal error:
> This does not appear to be a valid pdo file
> -------------------------------------------------------
> 

Version 3.3.x of g_wham is non-functional; this error message was reported
numerous times.  Upgrade to the newest version of Gromacs (4.0.5), and try
again.  The code has been fixed and should handle your files.

-Justin

-- 
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Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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