[gmx-users] Re: g_energy problem with 4.5.1 and 4.5.2
rossen at kth.se
Wed Nov 3 01:01:47 CET 2010
On 11/2/10 1:35 PM, Sander Pronk wrote:
> Hi Michael,
> I've just committed a fix to the git repository (it's in the release-4-5-patches branch)
> There were 2 problems
> - Energy files in double precision couldn't be read in 4.5.2, due to an overly strict error checking issue.
> - The box matrix wasn't written out correctly (in any 4.5 version).
> As Berk said, these issues are bad enough for a new version to be released soon.
We'll have one next Monday then!
> On 2 Nov 2010, at 11:55 , Michael Brunsteiner wrote:
>> Sander pronk wrote:
>>> Hi Michael,
>>> I've been able to reproduce both problems - I'll fix them shortly.
>> thanks for your swift reply!
>> I assume any fix will be in the Git version only for some time
>> to come, right?
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