easyblock = 'PackedBinary' name = 'S4MPLE' version = '1.0.0' homepage = 'http://infochim.u-strasbg.fr/spip.php?rubrique152' description = """S4MPLE (Sampler For Multiple Protein-Ligand Entities) is a flexible molecular modeling tool, supporting empirical force field-driven conformational sampling and geometry optimization heuristics using a hybrid genetic algorithm (GA). """ toolchain = {'name': 'dummy', 'version': 'dummy'} # download from http://infochim.u-strasbg.fr/IMG/gz/S4MPLE-tar.gz and # rename to S4MPLE.tar.gz sources = ['S4MPLE.tar.gz'] sanity_check_paths = { 'files': ["S4MPLE"], 'dirs': [], } moduleclass = 'chem'