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  1. Run ./config Linux-amd64-MPI.postfix<postfix> to create an installation. <Postfix> is any label you wish to append to the NAMD directory.
  2. The new Charm++ and NAMD 2.7 use different platform names than they did in the past(e.g. Linux-x86_64-OpenMPI for NAMD 2.7 and Charm++ 6.2, but Linux-amd64-MPI for NAMD 2.6. This causes problems when looking for the Charm++ installation, so edit Make.charm in NAMD directory:
    Code Block
    CHARMBASE = /share/apps/charm-6.2.0/mpi-linux-x86_64-mpicxx
  3. Then edit Makearch in the Linux-amd64-MPI.postfix directory as follows, by changing the CHARM=... line:
    Code Block
    include .rootdir/Make.charm
include .rootdir/arch/Linux-amd64-MPI.arch
CHARM = $(CHARMBASE)
NAMD_PLATFORM = $(NAMD_ARCH)-MPI
include .rootdir/arch/$(NAMD_ARCH)$(NAMD_SUBARCH).base
  4. Try make in the installation directory.

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