PS - It is known that the latest version of Amber (18) does have
certain issues with Intel 18.X compilers (in fact, configure by
default does not let you use Intel 18 by default). So it's likely
Amber 16 has similar issues...
On Thu, Oct 11, 2018 at 11:59 AM Daniel Roe <daniel.r.roe.gmail.com> wrote:
>
> Hi,
>
> On Thu, Oct 11, 2018 at 11:56 AM Vito GENNA <vito.genna.irbbarcelona.org> wrote:
> > Apparently, intel/2018.3 is not efficient for amber18.
>
> Did you by any chance run the test cases with intel 2018.3 compiled
> code? If so, did they pass?
>
> In the meantime I'll check into this on my local cluster. Thanks for the report.
>
> -Dan
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Oct 11 2018 - 09:30:03 PDT
