[Openmm-betatesters] OpenCL error when using RPMD plugin

[Nabil Faruk]

Hi,
after positions and velocities have been set for the RPMD integrator, I get
the following error when calling getState():

OpenCL internal error: CL_INVALID_KERNEL_ARGS error executing
CL_COMMAND_NDRANGE_KERNEL on Tesla M2070 (Device 0).

OpenCL internal error: CL_INVALID_KERNEL_ARGS error executing
CL_COMMAND_NDRANGE_KERNEL on Tesla M2070 (Device 0).

terminate called after throwing an instance of 'OpenMM::OpenMMException'
  what():  Particle positions have not been set

This issue did not happen with OpenMM 4.1.1
Any thoughts? Thanks,

-- 
Nabil
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