Dear all,

I am currently looking to build AmberTools 21 with foss/201a. I managed to build it using the included BLAS but when I try to link with an external lib, sanity check fails as the binaries are linked to OpenBlas instead of flexiblas.

Before playing with the custom CMake modules in AmberTools, has anyone ever tried to compile AmberTools 21 with foss/2021a?

Any suggestion is welcome!

Thanks,
Frédéric

--

Frédéric WAUTELET
HPC Operations Engineer
Faculty of Sciences

T. +32(0)81725459
[email protected] <mailto:[email protected]>
http://www.ptci.unamur.be <http://www.ptci.unamur.be>

Université de Namur ASBL
Rue de Bruxelles 61 - 5000 Namur
Belgique

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