Ran Friedman wrote:
Berk Hess wrote:
It would also make the code more complicated than it already is.
Berk.
It may be useful to incorporate these things as part of the source but
to compile them only if requested by the user, as done e.g. in some
features of charmm. This will make the main code only minimally more
complex I guess.
This is basically how things work with some libraries, like FFT etc and
also with the QMMM interface.
There were recently several contributions that didn't make it to the
main code. This is very understandable, but I guess that as the GMX code
evolves, those contributions become outdated and force their users to
use older versions (at least for a while) or simply phase out.
Just wondering, but what are you thinking of here? Stuff that goes to
the contribution page on the website?
Ran.
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David van der Spoel, Ph.D.
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
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