[AMBER] AMBER 16 vs 18 on different cuda

From: Xiaoyu Wang <xwang181.hawk.iit.edu>
Date: Wed, 8 May 2019 15:08:11 -0500

Dear developers and users,

I compiled AMBER 18 with cuda 9.2 in order to run on RTX 2080 ti. The output file showed that EAMBER kept increasing until the program crashed. However, from a same starting file, AMBER 16 with cuda 9.0 did not have such problem. I also tested the program on CPUs and it ran normally like 16 with cuda 9.0. I will appreciate any suggestions on choosing cuda and any ideas regarding this problem.

Best wishes,

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Received on Wed May 08 2019 - 13:30:02 PDT
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