pele.takestep.TakestepInterface#

class pele.takestep.TakestepInterface[source]#

Interface for step taking classes

Methods

__call__(*args, **kwargs)

Call self as a function.

scale(factor)

scale the stepsize

takeStep(coords, **kwargs)

take a step

updateStep(accepted, **kwargs)

feedback from basin hopping if last step was accepted

Attributes