Commit ac37ee86 authored by peastman's avatar peastman
Browse files

Added a link to the manual section describing vsite types

parent 79be9b11
...@@ -172,7 +172,8 @@ Each :code:`<VirtualSite>` tag indicates an atom in the residue that should ...@@ -172,7 +172,8 @@ Each :code:`<VirtualSite>` tag indicates an atom in the residue that should
be represented with a virtual site. The :code:`type` attribute may equal be represented with a virtual site. The :code:`type` attribute may equal
:code:`"average2"`\ , :code:`"average3"`\ , :code:`"outOfPlane"`\ , or :code:`"average2"`\ , :code:`"average3"`\ , :code:`"outOfPlane"`\ , or
:code:`"localCoords"`\ , which correspond to the TwoParticleAverageSite, ThreeParticleAverageSite, :code:`"localCoords"`\ , which correspond to the TwoParticleAverageSite, ThreeParticleAverageSite,
OutOfPlaneSite, and LocalCoordinatesSite classes respectively. The :code:`siteName` OutOfPlaneSite, and LocalCoordinatesSite classes respectively. See Section
:numref:`virtual-sites` for descriptions of how the virtual site classes work. The :code:`siteName`
attribute gives the name of the atom to represent with a virtual site. The atoms attribute gives the name of the atom to represent with a virtual site. The atoms
it is calculated based on are specified by :code:`atomName1`\ , :code:`atomName2`\ , etc. it is calculated based on are specified by :code:`atomName1`\ , :code:`atomName2`\ , etc.
(Some old force fields use the deprecated tags :code:`index`, :code:`atom1`, (Some old force fields use the deprecated tags :code:`index`, :code:`atom1`,
......
...@@ -116,6 +116,8 @@ call :code:`setIntegrationForceGroups()` on the :class:`Integrator`. Any groups ...@@ -116,6 +116,8 @@ call :code:`setIntegrationForceGroups()` on the :class:`Integrator`. Any groups
omitted will be ignored during simulation, but can be queried at any time by omitted will be ignored during simulation, but can be queried at any time by
calling :code:`getState()`. calling :code:`getState()`.
.. _virtual-sites:
Virtual Sites Virtual Sites
************* *************
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