name = 'NAMD' version = '2.10b1' versionsuffix = '-mpi' homepage = 'http://www.ks.uiuc.edu/Research/namd/' description = """NAMD is a parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems.""" toolchain = {'name': 'ictce', 'version': '5.5.0'} toolchainopts = {'opt': True, 'pic': True, 'usempi': True} sources = ['NAMD_%(version)s_Source.tar.gz'] dependencies = [ ('Tcl', '8.5.16'), ('FFTW', '3.3.4'), ] charm_arch = 'mpi-linux-x86_64' moduleclass = 'chem'