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Releases: Ferg-Lab/pines

v0.1.0

20 Jul 15:52
34c0c73
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First version release. Compatible with PLUMED <=2.9 and GROMACS.

Installation

If PLUMED2+MD Engine exists,

Download this compressed file and unpack
Execute patch_piv_mesa_plumed.sh <path_to_PLUMED>
Re-install PLUMED2 with --enable-modules=all or --enable-modules=pines+annfunc
else,

Download MD Engine & PLUMED2.
Download this repository
Execute patch_piv_mesa_plumed.sh <path_to_PLUMED>
Follow standard MD Engine + PLUMED2 installation process with --enable-modules=all or --enable-modules=pines+annfunc