import os
import sys
sys.path.append(os.path.normpath(os.path.join(os.path.abspath(__file__), '..', '..', '..', "common")))
from env_indigo import *

indigo = Indigo()


for idx, m in enumerate(indigo.iterateSmilesFile(joinPath("molecules", "b2000.smi"))):
    fp = m.fingerprint("full")
    