Commit 76f7acf7 authored by Nate Stanley's avatar Nate Stanley
Browse files

Merge branch 'master' into update_ug

parents 4fd6934b c3847685
This diff is collapsed.
This diff is collapsed.
.. currentmodule:: simtk.openmm.openmm
OpenMM Python API
=================
The Python API provides information about the classes and methods available in OpenMM for Python developers.
OpenMM consists of two parts. First, there is a set of :ref:`libraries <library>` for performing many types of computations needed for molecular simulations: force evaluation, numerical integration, energy minimization, etc.
Second, there is an :ref:`application layer <app>`, a set of Python libraries providing a high level interface for running simulations. This layer is targeted at computational biologists or other people who want to run simulations, and who may or may not be programmers.
See the user guide for more details.
.. toctree::
:maxdepth: 2
app
library
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
This diff is collapsed.
......@@ -449,4 +449,5 @@ void ContextImpl::loadCheckpoint(istream& stream) {
parameters[name] = value;
}
updateStateDataKernel.getAs<UpdateStateDataKernel>().loadCheckpoint(*this, stream);
hasSetPositions = true;
}
This diff is collapsed.
This diff is collapsed.
Markdown is supported
0% or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment