VerletIntegrator¶
-
class
OpenMM
::
VerletIntegrator
¶ This is an
Integrator
which simulates aSystem
using the leap-frog Verlet algorithm.Methods
Create a
VerletIntegrator
.Advance a simulation through time by taking a series of time steps.
-
VerletIntegrator
(double stepSize)¶ Create a
VerletIntegrator()
.- Parameters
stepSize – the step size with which to integrate the system (in picoseconds)
-
void
step
(int steps)¶ Advance a simulation through time by taking a series of time steps.
- Parameters
steps – the number of time steps to take
-