Commit 79929693 authored by peastman's avatar peastman
Browse files

More documentation on MonteCarloMembraneBarostat

parent 3439d873
......@@ -1196,6 +1196,22 @@ change size.
system.addForce(MonteCarloAnisotropicBarostat((1, 1, 1)*bar, 300*kelvin,
False, True, False))
There is a third barostat designed specifically for simulations of membranes.
It assumes the membrane lies in the XY plane, and treats the X and Y axes of the
box differently from the Z axis. It also applies a uniform surface tension in
the plane of the membrane. The following line adds a membrane barostat that
applies a pressure of 1 bar and a surface tension of 200 bar*nm. It specifies
that the X and Y axes are treated isotropically while the Z axis is free to
change independently.
::
system.addForce(MonteCarloMembraneBarostat(1*bar, 200*bar*nanometer,
MonteCarloMembraneBarostat.XYIsotropic, MonteCarloMembraneBarostat.ZFree, 300*kelvin))
See the API documentation for details about the allowed parameter values and
their meanings.
Energy Minimization
===================
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