[gmx-developers] Coming on to help in GROMACS development

Erik Lindahl lindahl at sbc.su.se
Tue Mar 15 16:47:38 CET 2005


On Mar 15, 2005, at 4:43 PM, Berk Hess wrote:

> Erik Lindahl wrote:
>> Hi,
>> The only major outstanding part for 3.3 is the QM/MM interface, and 
>> then there's some minor clean-up and testing.  I'd suggest waiting 
>> until after that release before we add significant new functionality.
> Don't forget the free-energy loops.
Already have them working in my version, but since I calculate energies 
too I need to adapt it before adding to CVS, so I included that in 
minor clean-up :-)


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