Search found 2 matches
- Wed Apr 19, 2017 4:39 pm
- Forum: OpenMM
- Topic: Benchmarks/informed guesses for OpenMM GPU speed on a 200K atom system?
- Replies: 4
- Views: 834
Re: Benchmarks/informed guesses for OpenMM GPU speed on a 200K atom system?
Which I plan on doing eventually, but doesn't help when I still need to find a GPU equivalent to Amazon AWS (or get set up there) and get everything set up there rather than my laptop, and could use an estimate tonight
- Wed Apr 19, 2017 4:26 pm
- Forum: OpenMM
- Topic: Benchmarks/informed guesses for OpenMM GPU speed on a 200K atom system?
- Replies: 4
- Views: 834
Benchmarks/informed guesses for OpenMM GPU speed on a 200K atom system?
I'm interested to know if there are any benchmarks / examples of OpenMM GPU speed on a 200K atom system, explicit solvent, PME, 2 fs step. I didn't see any on the web page, but thought people might know some examples.