[gmx-developers] Re: g_sas difference between 4.0.7 and 4.1(4.0.99_development_20090425)/4.5.2

[Ilya Chorny]

Can anyone point me to the changes that were made for g_sas between 4.0.7
and 4.5? I get different results (see below).  I read through the bug and
revision history and could not find anything.

g_sas 4.0.7:

@ s0 legend "Hydrophobic"
@ s1 legend "Hydrophilic"
@ s2 legend "Total"
@ s3 legend "D Gsolv"
         0     119.157     115.294     234.451    -586.244


g_sas 4.1(4.0.99_development_20090425):

@ s0 legend "Hydrophobic"
@ s1 legend "Hydrophilic"
@ s2 legend "Total"
@ s3 legend "D Gsolv"
         0     99.1454     107.813     206.958    -517.304

g_sas 4.5.2

@ s0 legend "Hydrophobic"
@ s1 legend "Hydrophilic"
@ s2 legend "Total"
@ s3 legend "D Gsolv"
         0     99.1454     107.813     206.958    -517.304


-- 
Ilya Chorny Ph.D.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-developers/attachments/20110408/77f844d7/attachment.html>