Hello Amber Users,
I was trying to reproduce the simulation from this tutorial:
http://ambermd.org/tutorials/advanced/tutorial22/ using original files and
scripts. I was using Amber14 with AmberTools 14.
I ran my simulation on a single Titan Black GPU and according to mdinfo
file it will last about 132 hours. I have Amber compiled with Cuda Toolkit
6.5 and the driver version is 340.29.
Should it run so long or does that mean that something is wrong with
software and/or hardware?
Best regards,
Karolina Markowska
PhD student
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Received on Thu Oct 29 2015 - 03:00:03 PDT
