org.openscience.cdk.smsd.filters

Class PostFilter

java.lang.Object

org.openscience.cdk.smsd.filters.PostFilter

Deprecated.

SMSD has been deprecated from the CDK with a newer, more recent version of SMSD is available at http://github.com/asad/smsd.

@Deprecated
public class PostFilter
extends Object

Class that cleans redundant mappings from the solution set.

1. 1: Stereo match, bond type, ring etc,
2. 2: Fragment size,
3. 3: Bond breaking energy

Author:

Syed Asad Rahman <asad@ebi.ac.uk>

Source code:

master

Belongs to CDK module:

smsd

Constructor Summary

Constructors

Constructor and Description
PostFilter() Deprecated.

Method Summary

Modifier and Type	Method and Description
static List<Map<Integer,Integer>>	filter(List<List<Integer>> mappings) Deprecated. Creates a new instance of Post Filter and removes redundant mapping(s).

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Constructor Detail

PostFilter

public PostFilter()

Deprecated.

Method Detail

filter

public static List<Map<Integer,Integer>> filter(List<List<Integer>> mappings)

Deprecated.

Creates a new instance of Post Filter and removes redundant mapping(s).

Parameters:

mappings -

Returns:

Filtered non-redundant mappings