NAMD + PLUMED COMPILATION

From: Francesco Pietra (chiendarret_at_gmail.com)
Date: Thu Feb 28 2013 - 11:02:28 CST

Sorry, previously I forgot the subject

---------- Forwarded message ----------
From: Francesco Pietra <chiendarret_at_gmail.com>
Date: Thu, Feb 28, 2013 at 5:59 PM
Subject:
To: NAMD <namd-l_at_ks.uiuc.edu>, giacomo.fiorin_at_gmail.com

Hi:
Probably this message of mine, about the compilation of NAMD with
PLUMED included, has gone submerged, and thus unnoticed (or it is such
a naive question that does not warrant a reply):

Thanks of the advice. A doubt about the last stage, when I have
everything (namd code, tcl fftw, plumed with its env var) under the
namd directory,

export plumedir="root_of_plumed_package"
cp $plumedir/patches/plumedpatch_namd_x.y.sh
./config Linux-x86_64-g++ --charm-arch multicore-linux64 --with-cuda
./plumedpatch_namd_2.9.sh -patch
make

is "--charm-arch multicore-linux64 --with-cuda" correct, or just
"--with-cuda" only?

thanks francesco

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