annotate mayachemtools/docs/scripts/html/TextFilesToSDFiles.html @ 5:9a001a14a022 draft

Deleted selected files
author deepakjadmin
date Thu, 15 Dec 2016 14:04:29 -0500
parents 73ae111cf86f
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
0
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
1 <html>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
2 <head>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
3 <title>MayaChemTools:Documentation:TextFilesToSDFiles.pl</title>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
4 <meta http-equiv="content-type" content="text/html;charset=utf-8">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
5 <link rel="stylesheet" type="text/css" href="../../css/MayaChemTools.css">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
6 </head>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
7 <body leftmargin="20" rightmargin="20" topmargin="10" bottommargin="10">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
8 <br/>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
9 <center>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
10 <a href="http://www.mayachemtools.org" title="MayaChemTools Home"><img src="../../images/MayaChemToolsLogo.gif" border="0" alt="MayaChemTools"></a>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
11 </center>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
12 <br/>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
13 <div class="DocNav">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
14 <table width="100%" border=0 cellpadding=0 cellspacing=2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
15 <tr align="left" valign="top"><td width="33%" align="left"><a href="./TextFilesToHTML.html" title="TextFilesToHTML.html">Previous</a>&nbsp;&nbsp;<a href="./index.html" title="Table of Contents">TOC</a>&nbsp;&nbsp;<a href="./TopologicalAtomPairsFingerprints.html" title="TopologicalAtomPairsFingerprints.html">Next</a></td><td width="34%" align="middle"><strong>TextFilesToSDFiles.pl</strong></td><td width="33%" align="right"><a href="././code/TextFilesToSDFiles.html" title="View source code">Code</a>&nbsp;|&nbsp;<a href="./../pdf/TextFilesToSDFiles.pdf" title="PDF US Letter Size">PDF</a>&nbsp;|&nbsp;<a href="./../pdfgreen/TextFilesToSDFiles.pdf" title="PDF US Letter Size with narrow margins: www.changethemargins.com">PDFGreen</a>&nbsp;|&nbsp;<a href="./../pdfa4/TextFilesToSDFiles.pdf" title="PDF A4 Size">PDFA4</a>&nbsp;|&nbsp;<a href="./../pdfa4green/TextFilesToSDFiles.pdf" title="PDF A4 Size with narrow margins: www.changethemargins.com">PDFA4Green</a></td></tr>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
16 </table>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
17 </div>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
18 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
19 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
20 <h2>NAME</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
21 <p>TextFilesToSDFiles.pl - Generate SD files from CSV or TSV TextFile(s)</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
22 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
23 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
24 <h2>SYNOPSIS</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
25 <p>TextFilesToSDFiles.pl TextFile(s)...</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
26 <p>TextFilesToSDFiles.pl [<strong>-h, --help</strong>] [<strong>--indelim</strong> comma | semicolon] [<strong>-l, --label</strong> yes | no]
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
27 [<strong>-o, --overwrite</strong>] [<strong>-r, --root</strong> rootname] [<strong>-w, --workingdir</strong> dirname] TextFile(s)...</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
28 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
29 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
30 <h2>DESCRIPTION</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
31 <p>Generate SD files from CSV or TSV <em>TextFile(s)</em>. The new SD files contain no structure data
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
32 as indicated by empty structure data block; Data fields and values in SD files are generated
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
33 using <em>TextFile(s)</em> column labels and corresponding data values.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
34 <p>Multiple <em>TextFile(s)</em> names are separated by space. The valid file extensions are
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
35 <em>.csv</em> and <em>.tsv</em> for comma/semicolon and tab delimited text files respectively.
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
36 All other file names are ignored. All the text files in a current directory can be specified
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
37 by <em>*.csv</em>, <em>*.tsv</em>, or the current directory name. The <strong>--indelim</strong> option
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
38 determines the format of <em>TextFile(s)</em>. Any file which doesn't correspond to
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
39 the format indicated by <strong>--indelim</strong> option is ignored.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
40 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
41 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
42 <h2>OPTIONS</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
43 <dl>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
44 <dt><strong><strong>-h, --help</strong></strong></dt>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
45 <dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
46 <p>Print this help message.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
47 </dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
48 <dt><strong><strong>--indelim</strong> <em>comma | semicolon</em></strong></dt>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
49 <dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
50 <p>Input delimiter for CSV <em>TextFile(s)</em>. Possible values: <em>comma or semicolon</em>.
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
51 Default value: <em>comma</em>. For TSV files, this option is ignored and <em>tab</em> is used as a
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
52 delimiter.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
53 </dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
54 <dt><strong><strong>-l, --label</strong> <em>yes | no</em></strong></dt>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
55 <dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
56 <p>First line contains column labels. Possible values: <em>yes or no</em>. Default value: <em>yes</em>.
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
57 Column labels are used to create SD data field labels; otherwise, data field labels look
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
58 like Column&lt;colnumber&gt;Data.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
59 </dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
60 <dt><strong><strong>-o, --overwrite</strong></strong></dt>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
61 <dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
62 <p>Overwrite existing files.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
63 </dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
64 <dt><strong><strong>-r, --root</strong> <em>rootname</em></strong></dt>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
65 <dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
66 <p>New SD file names are generated using the root: &lt;Root&gt;.sdf. Default new file names:
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
67 &lt;TextFileName&gt;WithNoStrData.sdf. This option is ignored for multiple input files.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
68 </dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
69 <dt><strong><strong>-w, --workingdir</strong> <em>dirname</em></strong></dt>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
70 <dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
71 <p>Location of working directory. Default: current directory.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
72 </dd>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
73 </dl>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
74 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
75 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
76 <h2>EXAMPLES</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
77 <p>To generate NewSample1.sdf file from Sample1.csv file, type:</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
78 <div class="ExampleBox">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
79 % TextFilesToSDFiles.pl -o -r NewSample1 Sample1.csv</div>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
80 <p>To generate NewSample1.sdf file from Sample1.tsv file which doesn't
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
81 contain column labels line, type:</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
82 <div class="ExampleBox">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
83 % TextFilesToSDFiles.pl --label no -o -r NewSample1 Sample1.tsv</div>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
84 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
85 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
86 <h2>AUTHOR</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
87 <p><a href="mailto:msud@san.rr.com">Manish Sud</a></p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
88 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
89 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
90 <h2>SEE ALSO</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
91 <p><a href="./JoinTextFiles.html">JoinTextFiles.pl</a>,&nbsp<a href="./MergeTextFiles.html">MergeTextFiles.pl</a>,&nbsp<a href="./ModifySDFilesDataFields.html">ModifySDFilesDataFields.pl</a>,&nbsp<a href="./ModifyTextFilesFormat.html">ModifyTextFilesFormat.pl</a>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
92 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
93 <p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
94 </p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
95 <h2>COPYRIGHT</h2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
96 <p>Copyright (C) 2015 Manish Sud. All rights reserved.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
97 <p>This file is part of MayaChemTools.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
98 <p>MayaChemTools is free software; you can redistribute it and/or modify it under
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
99 the terms of the GNU Lesser General Public License as published by the Free
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
100 Software Foundation; either version 3 of the License, or (at your option)
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
101 any later version.</p>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
102 <p>&nbsp</p><p>&nbsp</p><div class="DocNav">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
103 <table width="100%" border=0 cellpadding=0 cellspacing=2>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
104 <tr align="left" valign="top"><td width="33%" align="left"><a href="./TextFilesToHTML.html" title="TextFilesToHTML.html">Previous</a>&nbsp;&nbsp;<a href="./index.html" title="Table of Contents">TOC</a>&nbsp;&nbsp;<a href="./TopologicalAtomPairsFingerprints.html" title="TopologicalAtomPairsFingerprints.html">Next</a></td><td width="34%" align="middle"><strong>March 29, 2015</strong></td><td width="33%" align="right"><strong>TextFilesToSDFiles.pl</strong></td></tr>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
105 </table>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
106 </div>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
107 <br />
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
108 <center>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
109 <img src="../../images/h2o2.png">
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
110 </center>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
111 </body>
73ae111cf86f Uploaded
deepakjadmin
parents:
diff changeset
112 </html>