Re: [AMBER] bug in pmemd/src/cuda/gpu.cpp line 2852?

From: David A Case <david.case.rutgers.edu>
Date: Mon, 25 Oct 2021 14:56:50 -0600

On Mon, Oct 25, 2021, Thomas Zeiser wrote:
>
>gcc-11.2.0 fails to compile src/pmemd/src/cuda/gpu.cpp line 2852
>with "error: ordered comparison of pointer with integer zero".
>
>That line 2852 also look suspicious:
>if (nmrat[i][0] >= 0 && nmrat[i][1] >= 0 && nmrat[i][2] >= 0 && nmrat[3] >= 0) {

It seems quite clear that one should replace "nmrat[3]" above with
"nmrat[i][3]". Can you give that a try?

Thanks for the report.....dac


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Received on Mon Oct 25 2021 - 14:00:02 PDT
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