The script shows how to assess a protein conformation using DOPE.
4 from __future__
import print_function
13 def create_representation():
17 prot = IMP.atom.get_by_type(mp0, IMP.atom.CHAIN_TYPE)[0]
21 def add_dope(m, prot):
22 ps = IMP.atom.get_by_type(prot, IMP.atom.ATOM_TYPE)
40 print(
"creating representation")
41 (m, prot) = create_representation()
43 print(
"creating DOPE score function")
47 print(
"DOPE SCORE ::", d.evaluate(
False))