1 // ******************************************************************************
2 //
3 // Title: Force Field X.
4 // Description: Force Field X - Software for Molecular Biophysics.
5 // Copyright: Copyright (c) Michael J. Schnieders 2001-2025.
6 //
7 // This file is part of Force Field X.
8 //
9 // Force Field X is free software; you can redistribute it and/or modify it
10 // under the terms of the GNU General Public License version 3 as published by
11 // the Free Software Foundation.
12 //
13 // Force Field X is distributed in the hope that it will be useful, but WITHOUT
14 // ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS
15 // FOR A PARTICULAR PURPOSE. See the GNU General Public License for more
16 // details.
17 //
18 // You should have received a copy of the GNU General Public License along with
19 // Force Field X; if not, write to the Free Software Foundation, Inc., 59 Temple
20 // Place, Suite 330, Boston, MA 02111-1307 USA
21 //
22 // Linking this library statically or dynamically with other modules is making a
23 // combined work based on this library. Thus, the terms and conditions of the
24 // GNU General Public License cover the whole combination.
25 //
26 // As a special exception, the copyright holders of this library give you
27 // permission to link this library with independent modules to produce an
28 // executable, regardless of the license terms of these independent modules, and
29 // to copy and distribute the resulting executable under terms of your choice,
30 // provided that you also meet, for each linked independent module, the terms
31 // and conditions of the license of that module. An independent module is a
32 // module which is not derived from or based on this library. If you modify this
33 // library, you may extend this exception to your version of the library, but
34 // you are not obligated to do so. If you do not wish to do so, delete this
35 // exception statement from your version.
36 //
37 // ******************************************************************************
38 package ffx.potential.parsers;
39
40 import org.apache.commons.io.FilenameUtils;
41
42 import javax.swing.filechooser.FileFilter;
43 import java.io.BufferedReader;
44 import java.io.File;
45 import java.io.FileReader;
46
47 import static java.lang.Integer.parseInt;
48
49 /**
50 * The INTFileFilter class is used to choose TINKER Internal Coordinate (*.INT) files.
51 *
52 * @author Michael J. Schnieders
53 * @since 1.0
54 */
55 public final class INTFileFilter extends FileFilter {
56
57 /** Default Constructor. */
58 public INTFileFilter() {
59 }
60
61 /**
62 * This is a static version of the accept method.
63 *
64 * <p>This method return <code>true</code> if the file is a directory or matches the extension for
65 * TINKER internal coordinates (*.INT).
66 *
67 * @param file The File to examine.
68 * @return Returns true if this an INT file.
69 */
70 public static boolean isINT(File file) {
71 return new INTFileFilter().accept(file);
72 }
73
74 /**
75 * {@inheritDoc}
76 *
77 * <p>This method return <code>true</code> if the file is a directory or matches the extension for
78 * TINKER internal coordinates (*.INT).
79 */
80 @Override
81 public boolean accept(File file) {
82 if (file.isDirectory()) {
83 return true;
84 }
85 String ext = FilenameUtils.getExtension(file.getName());
86 return ext.toUpperCase().startsWith("INT");
87 }
88
89 /**
90 * acceptDeep
91 *
92 * @param parm a {@link java.io.File} object.
93 * @return a boolean.
94 */
95 public boolean acceptDeep(File parm) {
96 if (parm == null || parm.isDirectory() || !parm.canRead()) {
97 return false;
98 }
99
100 try (BufferedReader br = new BufferedReader(new FileReader(parm))) {
101 if (!br.ready()) {
102 // Empty File?
103 return false;
104 }
105 // If the first token is not an integer this file is not
106 // an Internal Coordinates File.
107 String rawdata = br.readLine();
108 String[] header = rawdata.trim().split(" +");
109 if (header.length == 0) {
110 return false;
111 }
112 try {
113 parseInt(header[0]);
114 } catch (Exception e) {
115 return false;
116 }
117 // If the first Atom line does not begin with an integer and
118 // contain three tokens, it is not an internal coordinate file.
119 String firstAtom = br.readLine();
120 if (firstAtom == null) {
121 return false;
122 }
123 String[] data = firstAtom.trim().split(" +");
124 if (data.length != 3) {
125 return false;
126 }
127 try {
128 parseInt(data[0]);
129 } catch (Exception e) {
130 return false;
131 }
132 return true;
133 } catch (Exception e) {
134 return true;
135 }
136 }
137
138 /**
139 * {@inheritDoc}
140 *
141 * <p>Provides a description of the INTFileFilter.
142 */
143 @Override
144 public String getDescription() {
145 return "TINKER Internal Coordinates (*.INT)";
146 }
147 }