# This file is an EasyBuild reciPY as per https://github.com/hpcugent/easybuild # Author: Ravi Tripathi # Email: ravi89@uab.edu easyblock = "Tarball" name = 'LeadIT' version = '2.1.9' homepage = 'http://www.biosolveit.de/LeadIT/index.html' description = """Visually Informed LeadOpt""" toolchain = SYSTEM # You need to get the software manually from # http://www.biosolveit.de/LeadIT/index.html sources = ['leadit-%(version)s-Linux-x64.tar.gz'] checksums = ['363fa557861c4d109fd595ab895df3fd'] modextrapaths = {'PATH': ''} sanity_check_paths = { 'files': ["leadit", "flexv", "hydescorer"], 'dirs': ["example", "doc"] } moduleclass = 'chem'