File: psw.py

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#!/usr/bin/env python
# This code is part of the Biopython distribution and governed by its
# license.  Please see the LICENSE file that should have been included
# as part of this package.
#
"""
Bio.Wise contains modules for running and processing the output of
some of the models in the Wise2 package by Ewan Birney available from:
ftp://ftp.ebi.ac.uk/pub/software/unix/wise2/
http://www.ebi.ac.uk/Wise2/

Bio.Wise.psw is for protein Smith-Waterman alignments
Bio.Wise.dnal is for Smith-Waterman DNA alignments
"""

from __future__ import print_function

import os
import re
import sys

from Bio import Wise


_CMDLINE_PSW = ["psw", "-l", "-F"]
_OPTION_GAP_START = "-g"
_OPTION_GAP_EXTENSION = "-e"
_OPTION_SCORES = "-m"


class AlignmentColumnFullException(Exception):
    pass


class Alignment(list):
    def append(self, column_unit):
        try:
            self[-1].append(column_unit)
        except AlignmentColumnFullException:
            list.append(self, AlignmentColumn(column_unit))
        except IndexError:
            list.append(self, AlignmentColumn(column_unit))


class AlignmentColumn(list):
    def _set_kind(self, column_unit):
        if self.kind == "SEQUENCE":
            self.kind = column_unit.kind

    def __init__(self, column_unit):
        assert column_unit.unit == 0
        self.kind = column_unit.kind
        list.__init__(self, [column_unit.column, None])

    def __repr__(self):
        return "%s(%s, %s)" % (self.kind, self[0], self[1])

    def append(self, column_unit):
        if self[1] is not None:
            raise AlignmentColumnFullException

        assert column_unit.unit == 1

        self._set_kind(column_unit)
        self[1] = column_unit.column


class ColumnUnit(object):
    def __init__(self, unit, column, kind):
        self.unit = unit
        self.column = column
        self.kind = kind

    def __str__(self):
        return "ColumnUnit(unit=%s, column=%s, %s)" % (self.unit, self.column, self.kind)

    __repr__ = __str__

_re_unit = re.compile(r"^Unit +([01])- \[ *(-?\d+)- *(-?\d+)\] \[(\w+)\]$")


def parse_line(line):
    """
    >>> print(parse_line("Column 0:"))
    None
    >>> parse_line("Unit  0- [  -1-   0] [SEQUENCE]")
    ColumnUnit(unit=0, column=0, SEQUENCE)
    >>> parse_line("Unit  1- [  85-  86] [SEQUENCE]")
    ColumnUnit(unit=1, column=86, SEQUENCE)
    """
    match = _re_unit.match(line.rstrip())

    if not match:
        return

    return ColumnUnit(int(match.group(1)), int(match.group(3)), match.group(4))


def parse(iterable):
    """
    format

    Column 0:
    Unit  0- [  -1-   0] [SEQUENCE]
    Unit  1- [  85-  86] [SEQUENCE]

    means that seq1[0] == seq2[86] (0-based)
    """

    alignment = Alignment()
    for line in iterable:
        try:
            if os.environ["WISE_PY_DEBUG"]:
                print(line)
        except KeyError:
            pass

        column_unit = parse_line(line)
        if column_unit:
            alignment.append(column_unit)

    return alignment


def align(pair,
          scores=None,
          gap_start=None,
          gap_extension=None,
          *args, **keywds):

    cmdline = _CMDLINE_PSW[:]
    if scores:
        cmdline.extend((_OPTION_SCORES, scores))
    if gap_start:
        cmdline.extend((_OPTION_GAP_START, str(gap_start)))
    if gap_extension:
        cmdline.extend((_OPTION_GAP_EXTENSION, str(gap_extension)))
    temp_file = Wise.align(cmdline, pair, *args, **keywds)
    return parse(temp_file)


def main():
    print(align(sys.argv[1:3]))


def _test(*args, **keywds):
    import doctest
    doctest.testmod(sys.modules[__name__], *args, **keywds)

if __name__ == "__main__":
    if __debug__:
        _test()
    main()