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On 15/03/2012 12:05 PM, Wholly Peach wrote:
<blockquote
cite="mid:1331773508.34869.YahooMailNeo@web121302.mail.ne1.yahoo.com"
type="cite">
<div style="color:#000; background-color:#fff; font-family:times
new roman, new york, times, serif;font-size:12pt">Dear All,<br>
<br>
For the gromacs 3.3.3 and gromacs 4.5.5, for regular protein
molecular dynamics simulation, will you please tell me the
possible difference on their calculated results?<br>
</div>
</blockquote>
<br>
In principle, not very much difference in results. Big differences
in speed in parallel. See <a
href="http://www.gromacs.org/About_Gromacs/Release_Notes">http://www.gromacs.org/About_Gromacs/Release_Notes</a>
for some details.<br>
<br>
Mark<br>
<br>
<a href="http://www.gromacs.org/About_Gromacs/Release_Notes"></a>
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