Public Member Functions
	__init__ (self, a1, a2, length, exp_length, std)

	ToJSON (self, decimals=3)

Data Fields
	a1

	a2

	length

	exp_length

	std

Detailed Description

 Object to hold info on bond violation

Constructor arguments are available as attributes:

* a1 (:class:`ost.mol.AtomHandle`)
* a2 (:class:`ost.mol.AtomHandle`)
* length (:class:`float`)
* exp_length (:class:`float`)
* std (:class:`float`)

Definition at line 390 of file stereochemistry.py.

Constructor & Destructor Documentation

◆ init()

__init__	(	self,
		a1,
		a2,
		length,
		exp_length,
		std
	)

Definition at line 401 of file stereochemistry.py.

Member Function Documentation

◆ ToJSON()

ToJSON	(	self,
		decimals = `3`
	)

 Return JSON serializable dict

Atoms are represented by a string in format:
<chain_name>.<resnum>.<resnum_inscode>.<atom_name>

Definition at line 408 of file stereochemistry.py.

Field Documentation

◆ a1

a1

Definition at line 402 of file stereochemistry.py.

◆ a2

a2

Definition at line 403 of file stereochemistry.py.

◆ exp_length

exp_length

Definition at line 405 of file stereochemistry.py.

◆ length

length

Definition at line 404 of file stereochemistry.py.

◆ std

std

Definition at line 406 of file stereochemistry.py.

The documentation for this class was generated from the following file:

build-dev/stage/lib64/python3.11/site-packages/ost/mol/alg/stereochemistry.py

Public Member Functions

Data Fields