/* * Jalview - A Sequence Alignment Editor and Viewer * Copyright (C) 2005 AM Waterhouse, J Procter, G Barton, M Clamp, S Searle * * This program is free software; you can redistribute it and/or * modify it under the terms of the GNU General Public License * as published by the Free Software Foundation; either version 2 * of the License, or (at your option) any later version. * * This program is distributed in the hope that it will be useful, * but WITHOUT ANY WARRANTY; without even the implied warranty of * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the * GNU General Public License for more details. * * You should have received a copy of the GNU General Public License * along with this program; if not, write to the Free Software * Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301, USA */ package jalview.io; import jalview.datamodel.*; import jalview.util.*; import java.io.*; import java.util.*; /** * DOCUMENT ME! * * @author $author$ * @version $Revision$ */ public class MSFfile extends AlignFile { /** * Creates a new MSFfile object. */ public MSFfile() { } /** * Creates a new MSFfile object. * * @param inStr DOCUMENT ME! */ public MSFfile(String inStr) { super(inStr); } /** * Creates a new MSFfile object. * * @param inFile DOCUMENT ME! * @param type DOCUMENT ME! * * @throws IOException DOCUMENT ME! */ public MSFfile(String inFile, String type) throws IOException { super(inFile, type); } /** * DOCUMENT ME! */ public void parse() { int i = 0; boolean seqFlag = false; String key = new String(); Vector headers = new Vector(); Hashtable seqhash = new Hashtable(); String line; try { while ((line = nextLine()) != null) { StringTokenizer str = new StringTokenizer(line); while (str.hasMoreTokens()) { String inStr = str.nextToken(); //If line has header information add to the headers vector if (inStr.indexOf("Name:") != -1) { key = str.nextToken(); headers.addElement(key); } //if line has // set SeqFlag to 1 so we know sequences are coming if (inStr.indexOf("//") != -1) { seqFlag = true; } //Process lines as sequence lines if seqFlag is set if ((inStr.indexOf("//") == -1) && (seqFlag == true)) { //seqeunce id is the first field key = inStr; StringBuffer tempseq; //Get sequence from hash if it exists if (seqhash.containsKey(key)) { tempseq = (StringBuffer) seqhash.get(key); } else { tempseq = new StringBuffer(); seqhash.put(key, tempseq); } //loop through the rest of the words while (str.hasMoreTokens()) { //append the word to the sequence tempseq.append(str.nextToken()); } } } } } catch (IOException e) { System.err.println("Exception parsing MSFFile " + e); e.printStackTrace(); } this.noSeqs = headers.size(); //Add sequences to the hash for (i = 0; i < headers.size(); i++) { if (seqhash.get(headers.elementAt(i)) != null) { String head = headers.elementAt(i).toString(); String seq = seqhash.get(head).toString(); int start = -1; int end = -1; if (maxLength < head.length()) { maxLength = head.length(); } if (head.indexOf("/") > 0) { StringTokenizer st = new StringTokenizer(head, "/"); if (st.countTokens() == 2) { head = st.nextToken(); String tmp = st.nextToken(); st = new StringTokenizer(tmp, "-"); if (st.countTokens() == 2) { start = Integer.valueOf(st.nextToken()).intValue(); end = Integer.valueOf(st.nextToken()).intValue(); } } } // Replace ~ with a sensible gap character seq = seq.replace('~', '-'); Sequence newSeq = new Sequence(head, seq, start, end); seqs.addElement(newSeq); } else { System.err.println("MSFFile Parser: Can't find sequence for " + headers.elementAt(i)); } } } /** * DOCUMENT ME! * * @param seq DOCUMENT ME! * * @return DOCUMENT ME! */ public static int checkSum(String seq) { int check = 0; String sequence = seq.toUpperCase(); for (int i = 0; i < sequence.length(); i++) { try { int value = sequence.charAt(i); if (value!=-1) { check += (i % 57 +1) * value; } } catch (Exception e) { System.err.println("Exception during MSF Checksum calculation"); e.printStackTrace(); } } return check % 10000; } /** * DOCUMENT ME! * * @param s DOCUMENT ME! * * @return DOCUMENT ME! */ public static String print(SequenceI[] s) { return print(s, false); } /** * DOCUMENT ME! * * @param s DOCUMENT ME! * @param is_NA DOCUMENT ME! * * @return DOCUMENT ME! */ public static String print(SequenceI[] seqs, boolean is_NA) { SequenceI [] s = new SequenceI[seqs.length]; StringBuffer out = new StringBuffer("!!" + (is_NA ? "NA" : "AA") + "_MULTIPLE_ALIGNMENT 1.0\n\n"); // TODO: JBPNote : Jalview doesn't remember NA or AA yet. int max = 0; int maxid = 0; int i = 0; while ((i < seqs.length) && (seqs[i] != null)) { // Replace all internal gaps with . and external spaces with ~ s[i] =new Sequence(seqs[i].getName(),seqs[i].getSequence().replace('-', '.')); StringBuffer sb = new StringBuffer(s[i].getSequence()); for (int ii = 0; ii < sb.length(); ii++) { if (sb.charAt(ii) == '.') { sb.replace(ii, ii + 1, "~"); } else break; } for (int ii = sb.length() - 1; ii > 0; ii--) { if (sb.charAt(ii) == '.') { sb.replace(ii, ii + 1, "~"); } else break; } s[i].setSequence(sb.toString()); if (s[i].getSequence().length() > max) { max = s[i].getSequence().length(); } i++; } Format maxLenpad = new Format("%" + (new String("" + max)).length() + "d"); Format maxChkpad = new Format("%" + (new String("1" + max)).length() + "d"); i = 0; int bigChecksum = 0; int [] checksums = new int[s.length]; while ( i < s.length ) { checksums[i] = checkSum(s[i].getSequence()); bigChecksum += checksums[i]; i++; } long maxNB = 0; out.append(" MSF: " + s[0].getSequence().length() + " Type: " + (is_NA ? "N" : "P") + " Check: " + (bigChecksum%10000) + " ..\n\n\n"); String[] nameBlock = new String[s.length]; String[] idBlock = new String[s.length]; i=0; while ((i < s.length) && (s[i] != null)) { nameBlock[i] = new String(" Name: " + s[i].getName() + " "); idBlock[i] = new String("Len: " + maxLenpad.form(s[i].getSequence().length()) + " Check: " + maxChkpad.form(checksums[i]) + " Weight: 1.00\n"); if (s[i].getName().length() > maxid) { maxid = s[i].getName().length(); } if (nameBlock[i].length() > maxNB) { maxNB = nameBlock[i].length(); } i++; } if (maxid < 10) { maxid = 10; } if (maxNB < 15) { maxNB = 15; } Format nbFormat = new Format("%-" + maxNB + "s"); for (i = 0; (i < s.length) && (s[i] != null); i++) { out.append(nbFormat.form(nameBlock[i]) + idBlock[i]); } maxid++; out.append("\n\n//\n\n"); int len = 50; int nochunks = (max / len) + 1; if ((max % len) == 0) { nochunks--; } for (i = 0; i < nochunks; i++) { int j = 0; while ((j < s.length) && (s[j] != null)) { String name = s[j].getName(); out.append(new Format("%-" + maxid + "s").form(name)+ " "); for (int k = 0; k < 5; k++) { int start = (i * 50) + (k * 10); int end = start + 10; if ((end < s[j].getSequence().length()) && (start < s[j].getSequence().length())) { out.append(s[j].getSequence().substring(start, end)); if (k < 4) { out.append(" "); } else { out.append("\n"); } } else { if (start < s[j].getSequence().length()) { out.append(s[j].getSequence().substring(start)); out.append("\n"); } else { if (k == 0) { out.append("\n"); } } } } j++; } out.append("\n"); } return out.toString(); } /** * DOCUMENT ME! * * @return DOCUMENT ME! */ public String print() { return print(getSeqsAsArray()); } }