/* * Jalview - A Sequence Alignment Editor and Viewer (Version 2.9) * Copyright (C) 2015 The Jalview Authors * * This file is part of Jalview. * * Jalview 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 3 * of the License, or (at your option) any later version. * * Jalview 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 Jalview. If not, see . * The Jalview Authors are detailed in the 'AUTHORS' file. */ package jalview.util; import jalview.datamodel.SequenceI; import java.util.ArrayList; import java.util.List; /** * Assorted methods for analysing or comparing sequences. */ public class Comparison { private static final int EIGHTY_FIVE = 85; private static final int TO_UPPER_CASE = 'a' - 'A'; private static final char GAP_SPACE = ' '; private static final char GAP_DOT = '.'; private static final char GAP_DASH = '-'; public static final String GapChars = new String(new char[] { GAP_SPACE, GAP_DOT, GAP_DASH }); /** * DOCUMENT ME! * * @param ii * DOCUMENT ME! * @param jj * DOCUMENT ME! * * @return DOCUMENT ME! */ public static final float compare(SequenceI ii, SequenceI jj) { return Comparison.compare(ii, jj, 0, ii.getLength() - 1); } /** * this was supposed to be an ungapped pid calculation * * @param ii * SequenceI * @param jj * SequenceI * @param start * int * @param end * int * @return float */ public static float compare(SequenceI ii, SequenceI jj, int start, int end) { String si = ii.getSequenceAsString(); String sj = jj.getSequenceAsString(); int ilen = si.length() - 1; int jlen = sj.length() - 1; while (Comparison.isGap(si.charAt(start + ilen))) { ilen--; } while (Comparison.isGap(sj.charAt(start + jlen))) { jlen--; } int count = 0; int match = 0; float pid = -1; if (ilen > jlen) { for (int j = 0; j < jlen; j++) { if (si.substring(start + j, start + j + 1).equals( sj.substring(start + j, start + j + 1))) { match++; } count++; } pid = (float) match / (float) ilen * 100; } else { for (int j = 0; j < jlen; j++) { if (si.substring(start + j, start + j + 1).equals( sj.substring(start + j, start + j + 1))) { match++; } count++; } pid = (float) match / (float) jlen * 100; } return pid; } /** * this is a gapped PID calculation * * @param s1 * SequenceI * @param s2 * SequenceI * @return float */ public final static float PID(String seq1, String seq2) { return PID(seq1, seq2, 0, seq1.length()); } static final int caseShift = 'a' - 'A'; // Another pid with region specification public final static float PID(String seq1, String seq2, int start, int end) { return PID(seq1, seq2, start, end, true, false); } /** * Calculate percent identity for a pair of sequences over a particular range, * with different options for ignoring gaps. * * @param seq1 * @param seq2 * @param start * - position in seqs * @param end * - position in seqs * @param wcGaps * - if true - gaps match any character, if false, do not match * anything * @param ungappedOnly * - if true - only count PID over ungapped columns * @return */ public final static float PID(String seq1, String seq2, int start, int end, boolean wcGaps, boolean ungappedOnly) { int s1len = seq1.length(); int s2len = seq2.length(); int len = Math.min(s1len, s2len); if (end < len) { len = end; } if (len < start) { start = len - 1; // we just use a single residue for the difference } int elen = len - start, bad = 0; char chr1; char chr2; boolean agap; for (int i = start; i < len; i++) { chr1 = seq1.charAt(i); chr2 = seq2.charAt(i); agap = isGap(chr1) || isGap(chr2); if ('a' <= chr1 && chr1 <= 'z') { // TO UPPERCASE !!! // Faster than toUpperCase chr1 -= caseShift; } if ('a' <= chr2 && chr2 <= 'z') { // TO UPPERCASE !!! // Faster than toUpperCase chr2 -= caseShift; } if (chr1 != chr2) { if (agap) { if (ungappedOnly) { elen--; } else if (!wcGaps) { bad++; } } else { bad++; } } } if (elen < 1) { return 0f; } return ((float) 100 * (elen - bad)) / elen; } /** * Answers true if the supplied character is a recognised gap character, else * false. Currently hard-coded to recognise '-', '-' or ' ' (hyphen / dot / * space). * * @param c * * @return */ public static final boolean isGap(char c) { return (c == GAP_DASH || c == GAP_DOT || c == GAP_SPACE) ? true : false; } /** * Answers true if more than 85% of the sequence residues (ignoring gaps) are * A, G, C, T or U, else false. This is just a heuristic guess and may give a * wrong answer (as AGCT are also amino acid codes). * * @param seqs * @return */ public static final boolean isNucleotide(SequenceI[] seqs) { if (seqs == null) { return false; } int ntCount = 0; int aaCount = 0; for (SequenceI seq : seqs) { if (seq == null) { continue; } // TODO could possibly make an informed guess just from the first sequence // to save a lengthy calculation for (char c : seq.getSequence()) { if ('a' <= c && c <= 'z') { c -= TO_UPPER_CASE; } if (c == 'A' || c == 'G' || c == 'C' || c == 'T' || c == 'U') { ntCount++; } else if (!Comparison.isGap(c)) { aaCount++; } } } /* * Check for nucleotide count > 85% of total count (in a form that evades * int / float conversion or divide by zero). */ if (ntCount * 100 > EIGHTY_FIVE * (ntCount + aaCount)) { return true; } else { return false; } } /** * Convenience overload of isNucleotide * * @param seqs * @return */ public static boolean isNucleotide(SequenceI[][] seqs) { if (seqs == null) { return false; } List flattened = new ArrayList(); for (SequenceI[] ss : seqs) { for (SequenceI s : ss) { flattened.add(s); } } final SequenceI[] oneDArray = flattened.toArray(new SequenceI[flattened .size()]); return isNucleotide(oneDArray); } }