Core¶
The simulation core drives the MD step.
- halmd.mdsim.core.mdstep()¶
Perform a single MD integration step.
This method is invoked by halmd.observables.sampler.run().
- halmd.mdsim.core.on_prepend_integrate(slot)¶
Connect nullary slot to signal.
Returns: signal connection
- halmd.mdsim.core.on_integrate(slot)¶
Connect nullary slot to signal.
Returns: signal connection
- halmd.mdsim.core.on_append_integrate(slot)¶
Connect nullary slot to signal.
Returns: signal connection
- halmd.mdsim.core.on_prepend_finalize(slot)¶
Connect nullary slot to signal.
Returns: signal connection
- halmd.mdsim.core.on_finalize(slot)¶
Connect nullary slot to signal.
Returns: signal connection
- halmd.mdsim.core.on_append_finalize(slot)¶
Connect nullary slot to signal.
Returns: signal connection