[gmx-users] GROMACS with GPU

[Park, Jae Hyun nmn]

Dear GMX users,

I am installing GMX 4.5.3 with GPU.
But, the CUDA in my GPU machine is ver 4.0. Can I use this version of CUDA and openmm-3.1.1? Or, do I have to re-install CUDA 3.2 and openmm-2.0 as described in manual?

Thank you in advance for your kind instruction.
Jae H. Park


=======================
Jae Hyun Park, Ph. D.
Physics Division
Oak Ridge National Laboratory
PO. Box 2008, MS-6372
Oak Ridge, TN 37831
Phone (865) 241-1482
E-mail parkj at ornl.gov

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