[ghemical-devel] support for MPQC v2 was added

[Michael Banck]

On Mon, May 20, 2002 at 10:55:39AM +0300, Tommi Hassinen wrote:
> I just added to the common/qm1e_mpqc.* files capability to support both v1
> and v2 of MPQC. There are only some syntax changes between the versions,
> so they actually work the same way.

cool! :)
 
> The v2 support seems to work, at least in the few test cases that I have
> tried. However, the configuration system should be updated as well, so
> that it would detect the MPQC version. At the moment the version is
> temporarily set at the beginning of the qm1e_mpqc.h file. As you can see
> there (and from old Makefiles as well) the code expects an
> 
> 	MPQC_VERSION
> 
> macro to be defined either 1 or 2. So, Geoff and/or other configuration
> experts, could you look at this when you have some time?

I'm looking into it now, having read all flamewars on mailing lists and
not willing to do stuff for uni :)
 
laters,

Michael