Added SandBox/gromacs

2018-10-15 17:05:31 +02:00
parent 31b3df6831
commit 63c6b44461
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+#%Module1.0
+
+module-whatis		"GROMACS is a versatile package to perform molecular dynamics"
+module-url		"http://www.gromacs.org/"
+module-license		"See PREFIX/share/doc/COPYING"
+module-maintainer	"Marc Caubet <marc.caubet@psi.ch>"
+module-help		"
+GROMACS is a versatile package to perform molecular dynamics, i.e. simulate
+the Newtonian equations of motion for systems with hundreds to millions of
+particles.
+
+It is primarily designed for biochemical molecules like proteins, lipids and
+nucleic acids that have a lot of complicated bonded interactions, but since
+GROMACS is extremely fast at calculating the nonbonded interactions (that
+usually dominate simulations) many groups are also using it for research on
+non-biological systems, e.g. polymers.
+"
+