ost.bindings.hbplus Namespace Reference

Data Structures
class	HBond

Functions
def	HBondList (ent, hbplus_bin=None)
def	HBondScore (ent1, ent2, hbplus_bin=None)

Detailed Description

Interface to HB+ command line program

Author: Marco Biasini

Function Documentation

HBondList()

def ost.bindings.hbplus.HBondList	(		ent,
			hbplus_bin = None
	)

returns a list of HBonds found in the given entity (handle or view)

Definition at line 60 of file hbplus.py.

HBondScore()

def ost.bindings.hbplus.HBondScore	(		ent1,
			ent2,
			hbplus_bin = None
	)

returns percentage of hydrogen bonds in ent1 that are also present in ent2 in
the range of 0 to 1.

this function is slow as hell, and could be improved drastically by first
sorting the hydrogen bond lists by donor residue number.

Definition at line 85 of file hbplus.py.