make_comparison.py File Reference

Namespaces
	make_comparison

Functions
def	make_comparison.length (index)
def	make_comparison.angle (index)
def	make_comparison.torsion (index)

Variables
	make_comparison.parser = argparse.ArgumentParser()
	make_comparison.type
	make_comparison.int
	make_comparison.choices
	make_comparison.arguments = parser.parse_args()
dictionary	make_comparison.expected
dictionary	make_comparison.measured
bool	make_comparison.collecting_data = False
	make_comparison.current_section = None
	make_comparison.section_pattern = re.compile(r'(\w+) \‍((\d)/\d\)')
	make_comparison.value = float(line)
	make_comparison.match = section_pattern.match(line)
	make_comparison.loop = pdb.Model('solution.%d.pdb' % arguments.solution)
	make_comparison.backbone = loop.select_atoms('N', 'CA', 'C')
	make_comparison.coordinates = backbone.get_coordinates()
	make_comparison.indices = backbone.indices()
	make_comparison.wrap = len(coordinates)
dictionary	make_comparison.torsion_error = measured['torsions'] - expected['torsions']
dictionary	make_comparison.angle_error = measured['angles'] - expected['angles']
dictionary	make_comparison.length_error = measured['lengths'] - expected['lengths']