Re: [AMBER] errors in plumed and amber14 patch

From: <hannes.loeffler.stfc.ac.uk>
Date: Thu, 17 Mar 2016 08:41:37 +0000

> const&, PLMD::Matrix<double>&)]+0x4ef): undefined reference to `dgetri_'
> collect2: ld returned 1 exit status

This is the linker complaining that the symbol dgetri_ cannot get resolved (you don't show the relevant command line that was used to link the object files). You need to make sure that the linker uses the proper library for that. I think dgetri is a LAPACK function.

Your shell script does not seem to have any relevant compiled time options.
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Received on Thu Mar 17 2016 - 02:00:04 PDT
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