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| date | Wed, 20 Jan 2016 09:23:18 -0500 |
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| 1 <html> | |
| 2 <head> | |
| 3 <title>MayaChemTools:Documentation:Graph::CyclesDetection.pm</title> | |
| 4 <meta http-equiv="content-type" content="text/html;charset=utf-8"> | |
| 5 <link rel="stylesheet" type="text/css" href="../../css/MayaChemTools.css"> | |
| 6 </head> | |
| 7 <body leftmargin="20" rightmargin="20" topmargin="10" bottommargin="10"> | |
| 8 <br/> | |
| 9 <center> | |
| 10 <a href="http://www.mayachemtools.org" title="MayaChemTools Home"><img src="../../images/MayaChemToolsLogo.gif" border="0" alt="MayaChemTools"></a> | |
| 11 </center> | |
| 12 <br/> | |
| 13 <div class="DocNav"> | |
| 14 <table width="100%" border=0 cellpadding=0 cellspacing=2> | |
| 15 <tr align="left" valign="top"><td width="33%" align="left"><a href="./TopologicalPharmacophoreAtomTripletsFingerprints.html" title="TopologicalPharmacophoreAtomTripletsFingerprints.html">Previous</a> <a href="./index.html" title="Table of Contents">TOC</a> <a href="./GraphMatrix.html" title="GraphMatrix.html">Next</a></td><td width="34%" align="middle"><strong>Graph::CyclesDetection.pm</strong></td><td width="33%" align="right"><a href="././code/CyclesDetection.html" title="View source code">Code</a> | <a href="./../pdf/CyclesDetection.pdf" title="PDF US Letter Size">PDF</a> | <a href="./../pdfgreen/CyclesDetection.pdf" title="PDF US Letter Size with narrow margins: www.changethemargins.com">PDFGreen</a> | <a href="./../pdfa4/CyclesDetection.pdf" title="PDF A4 Size">PDFA4</a> | <a href="./../pdfa4green/CyclesDetection.pdf" title="PDF A4 Size with narrow margins: www.changethemargins.com">PDFA4Green</a></td></tr> | |
| 16 </table> | |
| 17 </div> | |
| 18 <p> | |
| 19 </p> | |
| 20 <h2>NAME</h2> | |
| 21 <p>CyclesDetection</p> | |
| 22 <p> | |
| 23 </p> | |
| 24 <h2>SYNOPSIS</h2> | |
| 25 <p>use Graph::CyclesDetection;</p> | |
| 26 <p>use Graph::CyclesDetection qw(:all);</p> | |
| 27 <p> | |
| 28 </p> | |
| 29 <h2>DESCRIPTION</h2> | |
| 30 <p><strong>CyclesDetection</strong> class provides the following methods:</p> | |
| 31 <p> <a href="#new">new</a>, <a href="#copy">Copy</a>, <a href="#detectcycles">DetectCycles</a>, <a href="#detectcyclesusingcollapsingpathgraphmethodology">DetectCyclesUsingCollapsingPathGraphMethodology</a> | |
| 32 , <a href="#getallcyclicpaths">GetAllCyclicPaths</a>, <a href="#getindependentcyclicpaths">GetIndependentCyclicPaths</a>, <a href="#stringifycyclesdetection">StringifyCyclesDetection</a> | |
| 33 </p><p>Cycles in a <strong>Graph</strong> are detected using collapsing path graph [Ref 31] | |
| 34 methodology.</p> | |
| 35 <p> | |
| 36 </p> | |
| 37 <h2>METHODS</h2> | |
| 38 <dl> | |
| 39 <dt><strong><a name="new" class="item"><strong>new</strong></a></strong></dt> | |
| 40 <dd> | |
| 41 <div class="OptionsBox"> | |
| 42 $NewCyclesDetection = new Graph::CyclesDetection($Graph);</div> | |
| 43 <p>Using specified <em>Graph</em>, <strong>new</strong> method creates a new <strong>CyclesDetection</strong> object and returns | |
| 44 newly created <strong>CyclesDetection</strong> object.</p> | |
| 45 </dd> | |
| 46 <dt><strong><a name="copy" class="item"><strong>Copy</strong></a></strong></dt> | |
| 47 <dd> | |
| 48 <div class="OptionsBox"> | |
| 49 $NewCyclesDetection = $CyclesDetection->Copy();</div> | |
| 50 <p>Copies <em>CyclesDetection</em> and its associated data using <strong>Storable::dclone</strong> and returns a new | |
| 51 <strong>CyclesDetection</strong> object.</p> | |
| 52 </dd> | |
| 53 <dt><strong><a name="detectcycles" class="item"><strong>DetectCycles</strong></a></strong></dt> | |
| 54 <dd> | |
| 55 <div class="OptionsBox"> | |
| 56 $CyclesDetection->DetectCycles();</div> | |
| 57 <p>Detects all cycles in a graph and returns <em>CyclesDetection</em>.</p> | |
| 58 </dd> | |
| 59 <dt><strong><a name="detectcyclesusingcollapsingpathgraphmethodology" class="item"><strong>DetectCyclesUsingCollapsingPathGraphMethodology</strong></a></strong></dt> | |
| 60 <dd> | |
| 61 <div class="OptionsBox"> | |
| 62 $CyclesDetection->DetectCyclesUsingCollapsingPathGraphMethodology();</div> | |
| 63 <p>Detects all cycles in a graph using collapsing path graph [Ref 31] methodology | |
| 64 and returns <em>CyclesDetection</em>.</p> | |
| 65 </dd> | |
| 66 <dt><strong><a name="getallcyclicpaths" class="item"><strong>GetAllCyclicPaths</strong></a></strong></dt> | |
| 67 <dd> | |
| 68 <div class="OptionsBox"> | |
| 69 @AllCyclicPaths = $CyclesDetection->GetAllCyclicPaths(); | |
| 70 <br/> $NumOfAllCyclicPaths = $CyclesDetection->GetAllCyclicPaths();</div> | |
| 71 <p>Returns an array containing references to all cyclic paths identified during cycles | |
| 72 detection. In scalar text, number of cycles is returned.</p> | |
| 73 </dd> | |
| 74 <dt><strong><a name="getindependentcyclicpaths" class="item"><strong>GetIndependentCyclicPaths</strong></a></strong></dt> | |
| 75 <dd> | |
| 76 <div class="OptionsBox"> | |
| 77 @IndependentCyclicPaths = $CyclesDetection->GetAllCyclicPaths(); | |
| 78 <br/> $NumOfIndependentCyclicPaths = $CyclesDetection->GetAllCyclicPaths();</div> | |
| 79 <p>Returns an array containing references to independent cyclic paths identified during cycles | |
| 80 detection. In scalar text, number of cycles is returned.</p> | |
| 81 <p>A set of independent cycles identified during cycles detection doesn't correspond to the basis set of | |
| 82 rings or smallest set of smallest rings (SSSR) [ Refs 29-30 ]; instead, set of cycles indentified | |
| 83 as independent cycles simply correpond to cycles which contain no other cycle as their | |
| 84 subcycles and can't be described as a linear combination of smaller cycles. And it also happens | |
| 85 to contain all the rings in basis set of rings and SSSR. In other words, it's a superset of a basis set | |
| 86 of cycles and SSSR. For example, six four membered cycles are indentified for cubane, which is one | |
| 87 more than the basis set of cycles.</p> | |
| 88 </dd> | |
| 89 <dt><strong><a name="stringifycyclesdetection" class="item"><strong>StringifyCyclesDetection</strong></a></strong></dt> | |
| 90 <dd> | |
| 91 <div class="OptionsBox"> | |
| 92 $String = $CyclesDetection->StringifyCyclesDetection();</div> | |
| 93 <p>Returns a string containing information about <em>CyclesDetection</em> object.</p> | |
| 94 </dd> | |
| 95 </dl> | |
| 96 <p> | |
| 97 </p> | |
| 98 <h2>AUTHOR</h2> | |
| 99 <p><a href="mailto:msud@san.rr.com">Manish Sud</a></p> | |
| 100 <p> | |
| 101 </p> | |
| 102 <h2>SEE ALSO</h2> | |
| 103 <p><a href="./Graph.html">Graph.pm</a>, <a href="./Path.html">Path.pm</a>, <a href="./PathGraph.html">PathGraph.pm</a> | |
| 104 </p> | |
| 105 <p> | |
| 106 </p> | |
| 107 <h2>COPYRIGHT</h2> | |
| 108 <p>Copyright (C) 2015 Manish Sud. All rights reserved.</p> | |
| 109 <p>This file is part of MayaChemTools.</p> | |
| 110 <p>MayaChemTools is free software; you can redistribute it and/or modify it under | |
| 111 the terms of the GNU Lesser General Public License as published by the Free | |
| 112 Software Foundation; either version 3 of the License, or (at your option) | |
| 113 any later version.</p> | |
| 114 <p> </p><p> </p><div class="DocNav"> | |
| 115 <table width="100%" border=0 cellpadding=0 cellspacing=2> | |
| 116 <tr align="left" valign="top"><td width="33%" align="left"><a href="./TopologicalPharmacophoreAtomTripletsFingerprints.html" title="TopologicalPharmacophoreAtomTripletsFingerprints.html">Previous</a> <a href="./index.html" title="Table of Contents">TOC</a> <a href="./GraphMatrix.html" title="GraphMatrix.html">Next</a></td><td width="34%" align="middle"><strong>March 29, 2015</strong></td><td width="33%" align="right"><strong>Graph::CyclesDetection.pm</strong></td></tr> | |
| 117 </table> | |
| 118 </div> | |
| 119 <br /> | |
| 120 <center> | |
| 121 <img src="../../images/h2o2.png"> | |
| 122 </center> | |
| 123 </body> | |
| 124 </html> |
