meld.remd.slave_runner¶

class meld.remd.slave_runner.SlaveReplicaExchangeRunner(step, max_steps, ramp_steps=None)[source]¶

This class coordinates running replica exchange on the slaves.

classmethod from_master(master)[source]¶

Initialize a new slave from a master.

Parameters:	master – a `meld.remd.master_runner.MasterReplicaExchangeRunner` to serve as a template
Returns:	a `SlaveReplicaExchangeRunner`

run(communicator, system_runner)[source]¶

Continue running slave jobs until done.

Parameters:	communicator – a communicator object for talking to the master system_runner – a system_runner object for actually running the simulations