Search found 22 matches

by Michael Schauperl
Thu Oct 10, 2013 4:28 am
Forum: OpenMM
Topic: CUDA Problem using the AMOEBA FF
Replies: 5
Views: 295

Re: CUDA Problem using the AMOEBA FF

Hi Peter, I tried what you said. Acutally the following plugins are loaded: ('libOpenMMDrudeSerialization.so', 'libOpenMMOpenCL.so', 'libOpenMMRPMDOpenCL.so', 'libOpenMMAmoebaSerialization.so', 'libOpenMMPME.so', 'libOpenMMCUDA.so') Which means that the AMOEBA CUDA plugin isnt loaded. If i am import...
by Michael Schauperl
Wed Oct 09, 2013 12:54 am
Forum: OpenMM
Topic: CUDA Problem using the AMOEBA FF
Replies: 5
Views: 295

CUDA Problem using the AMOEBA FF

Hi there, I just started to use the OpenMM package and i have an issue with using the AMOEBA FF. If i am running the testInstallation script everything is fine. Also if i am doing Amber calculations on the CUDA platform everything is smooth. But if i am running an AMOEBA calculation i got the follow...