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#########################################################################
# MacSyFinder - Detection of macromolecular systems in protein dataset #
# using systems modelling and similarity search. #
# Authors: Sophie Abby, Bertrand Neron #
# Copyright (c) 2014-2024 Institut Pasteur (Paris) and CNRS. #
# See the COPYRIGHT file for details #
# #
# This file is part of MacSyFinder package. #
# #
# MacSyFinder 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. #
# #
# MacSyFinder 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 MacSyFinder (COPYING). #
# If not, see <https://www.gnu.org/licenses/>. #
#########################################################################
import shutil
import tempfile
import os
import sys
import inspect
import unittest
import itertools
import colorlog
import pandas as pd
from tests import MacsyTest
from macsypy.scripts import macsyfinder
from macsypy.error import OptionError
from macsypy.system import System, AbstractUnordered, RejectedCandidate
class Test(MacsyTest):
@classmethod
def setUpClass(cls) -> None:
cls._index_dir = os.path.join(tempfile.gettempdir(), 'test_macsyfinder_index')
if not os.path.exists(cls._index_dir):
os.makedirs(cls._index_dir)
@classmethod
def tearDownClass(cls) -> None:
if os.path.exists(cls._index_dir):
shutil.rmtree(cls._index_dir)
def setUp(self):
self.tmp_dir = tempfile.gettempdir()
# reset System, AbstractUnordered internal id to have predictable results (Systems, ...) id
# it's works only if there is only one replicon
# for gembase the order is not guarantee
System._id = itertools.count(1)
AbstractUnordered._id = itertools.count(1)
self.all_systems_tsv = "all_systems.tsv"
self.all_systems_txt = "all_systems.txt"
self.all_best_solutions = "all_best_solutions.tsv"
self.best_solution = "best_solution.tsv"
self.summary = "best_solution_summary.tsv"
self.rejected_candidates_txt = "rejected_candidates.txt"
self.rejected_candidates_tsv = "rejected_candidates.tsv"
self.uncomplete_systems = "uncomplete_systems.txt"
self.loners = "best_solution_loners.tsv"
self.multisystems = "best_solution_multisystems.tsv"
def tearDown(self):
try:
pass
# self.out_dir is set in self._macsyfinder_run
shutil.rmtree(self.out_dir)
except Exception:
pass
# remove handlers
# otherwise at each test init_logger is called
# and the handlers are accumulated and produce multiple values
logger = colorlog.getLogger('macsypy')
for h in logger.handlers[:]:
logger.removeHandler(h)
@unittest.skipIf(not shutil.which('hmmsearch'), 'hmmsearch not found in PATH')
def test_gembase(self):
"""
"""
expected_result_dir = self.find_data("functional_test_gembase")
args = "--db-type=gembase " \
f"--models-dir={self.find_data('models')} " \
"--models TFF-SF all " \
"--out-dir={out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
# all_systems_tsv, all_best_solutions, best_solution
# provides system with non predictable id
# and the order between equivalent solutions is not predictable
# so the output is not predictable
# even the biological meaning is good
# so I disabled them from test until I found a fix
# we steel check the overall system found (summary)
# the loners and multisystems hits
for file_name in (# self.all_systems_tsv,
# self.all_best_solutions,
# self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
expected_result = self.find_data(expected_result_dir, self.rejected_candidates_txt)
get_results = os.path.join(self.out_dir, self.rejected_candidates_txt)
self.assertFileEqual(expected_result, get_results, comment="#")
@unittest.skipIf(not shutil.which('hmmsearch'), 'hmmsearch not found in PATH')
def test_timeout(self):
"""
"""
expected_result_dir = self.find_data("functional_test_timeout")
args = "--db-type=gembase " \
f"--models-dir={self.find_data('models')} " \
"--models TFF-SF all " \
"--out-dir={out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path " \
"--timeout 2 "
with self.catch_io(out=True, err=True):
with self.catch_log() as log:
self._macsyfinder_run(args)
log_msg = log.get_value().strip()
self.assertEqual(log_msg,
"""Timeout is over. Aborting
The THHY002.0321.00001.C001 cannot be solved in time skip it!
The replicon THHY002.0321.00001.C001 cannot be solved before timeout. SKIP IT.""")
# test only if THHY002.0321.00001.C001 has_been skipped
for file_name in (self.summary,):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
for file_name in (self.summary,
self.all_systems_tsv,
self.rejected_candidates_tsv,
self.best_solution,
self.all_best_solutions):
with self.subTest(file_name=file_name):
# that THHY002.0321.00001.C001 has_been skipped is in comment of each file
get_results = os.path.join(self.out_dir, file_name)
with open(get_results) as results:
lines = results.readlines()
self.assertEqual(lines[4],
"# WARNING: The replicon 'THHY002.0321.00001.C001' has been SKIPPED. Cannot be solved before timeout.\n")
# that results don't contain results about THHY002.0321.00001.C001 replicon
replicons = pd.read_csv(get_results, sep='\t', comment='#').replicon.drop_duplicates()
self.assertEqual(len(replicons), 2)
def test_only_loners(self):
# genetic organization of MOBP1_twice.fast
# gene MOBP1 MOBP1
# gene_id 0832 0885
# pos 8 19
# [ ] [ ]
expected_result_dir = self.find_data("functional_test_only_loners")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m test_loners MOB_cf_T5SS " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_circular(self):
# genetic organization of test_3.fasta
# gene abc mfp omf omf abc gspd
# gene id 01397 01398 01548 01562 01399 01400
# pos 2 3 19 27 37 38
# clst ] [
# syst (abc,2), (mfp,3), (abc,37), (gspd, 38)
# in T12SS-simple-exch omf is not a loner
expected_result_dir = self.find_data("functional_test_ordered_circular")
args = "--db-type ordered_replicon " \
"--replicon-topology circular " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_gzip(self):
# genetic organization of test_3.fasta.gz
# gene abc mfp omf omf abc gspd
# gene id 01397 01398 01548 01562 01399 01400
# pos 2 3 19 27 37 38
# clst ] [
# syst (abc,2), (mfp,3), (abc,37), (gspd, 38)
# in T12SS-simple-exch omf is not a loner
# the input data: hmm profile and sequence-db, are gziped
expected_result_dir = self.find_data("functional_test_gzip")
args = "--db-type ordered_replicon " \
"--replicon-topology circular " \
f"--models-dir {self.find_data('models')} " \
"-m functional_gzip T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_linear(self):
# genetic organization of test_3.fasta
# gene abc mfp omf omf abc gspd
# gene id 01397 01398 01548 01562 01399 01400
# pos 2 3 19 27 37 38
# clst [ M A ] M M [ M A ]
# syst no system
# in T12SS-simple-exch omf is not a loner
expected_result_dir = self.find_data("functional_test_ordered_linear")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_1_cluster_3_loners(self):
# genetic organization of test_1.fasta
#
# gene omf mfp abc mfp abc gspd omf omf omf
# gene id 01360 01361 01397 01398 01399 01400 01506 01548 01562
# pos 2 3 11 12 13 14 23 32 46
# clst [ML M] [ M M M ME] [ML] [ML] [ML]
# syst [abc mfp abc gspd omf] with equivalent for omf46 [omf23 omf32]
# score 1 1 0 0 .7 = 2.7
# loners X omf omf omf
# omf2 colocate with mfp3 => not considerde as Loner
expected_result_dir = self.find_data("functional_test_ordered_1_cluster_3_loners")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_1_cluster_and_clusters_of_loners(self):
# genetic organization of test_15.fasta
#
# gene abc mfp abc gspd omf omf omf omf
# gene id 01397 01398 01399 01400 01506 01360 01548 01562
# pos 9 10 11 12 21 22 44 45
# clst [ M M M ME ] [ML ML] [ML ML]
# syst [abc mfp abc gspd] 2 clusters of 2 loners but considered as 4 loners
# score 1 1 0 0 .7 = 2.7
# loners omf omf omf omf
# omf 23 24 and 30 31 are clusters of loners with same gene => consider as Loner
expected_result_dir = self.find_data("functional_test_ordered_1_cluster_and_clusters_of_loners")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_2_clusters_3_loners(self):
# genetic organization of test_5.fasta
#
# gene omf mfp abc mfp abc gspd omf omf omf abc mfp gspd
# gene id 01360 01361 01397 01398 01399 01400 01506 01548 01562 01150 01361 0409
# pos 2 3 11 12 13 14 23 32 46 55 56 57
# clst [ ML ML] [M M M ME] [ML] [ML] [ML] [ M M ME]
# syst [abc mfp abc gspd] [omf] [omf] [omf] [abc mfp gspd ]
# 2 systems [abc mfp abc gspd omf46] with equivalent for omf46 [omf23 omf32]
# score 1 1 0 0 .7 = 2.7
# [abc mfp gspd omf46] with equivalent for omf46 [omf23 omf32]
# 1 1 0 .7 = 2.7
expected_result_dir = self.find_data("functional_test_ordered_2_clusters_3_loners")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_2_clusters_1_loner(self):
# genetic organization of test_6.fasta
#
# gene mfp abc mfp abc gspd omf abc mfp gspd
# gene id 01361 01397 01398 01399 01400 01506 01150 01361 00409
# pos 2 10 11 12 13 22 51 52 53
# clst M [ M M M ME] [ML] [M M ME]
# syst [abc mfp abc gspd] [omf] [abc mfp gspd ]
# 2 systems [abc mfp abc gspd omf22] with warning 1 loner 2 systems
# score 1 1 0 0 .7 = 2.7
# [abc mfp gspd omf22] with with warning 1 loner 2 systems
# 1 1 0 .7 = 2.7
expected_result_dir = self.find_data("functional_test_ordered_2_clusters_1_loner")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_1_loner_in_clust(self):
# genetic organization of test_2.fasta
#
# gene abc mfp abc gspd omf omf omf
# gene id 01397 01398 01399 01400 01506 01548 01562
# pos 8 9 10 11 13 29 43
# clst [ M M M ME M] [ML] [ML]
# syst [abc mfp abc gspd omf]
# score 1 1 0 0 1 = 3.0
expected_result_dir = self.find_data("functional_test_ordered_1_loner_in_clust")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_1_loner_exch_in_clust(self):
# genetic organization of test_8.fasta
#
# gene abc mfp abc gspd gspf omf omf
# gene id 01397 01398 01399 01400 02599 01548 01562
# pos 8 9 10 11 13 29 43
# clst [ M M M ME MLE] [ML] [ML]
# syst [abc mfp abc gspd gspf]
# score 1 1 0 0 0.7 = 2.7
expected_result_dir = self.find_data("functional_test_ordered_1_loner_exch_in_clust")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_1_clusters_3_loners_w_exchangeable(self):
# genetic organization of test_7.fasta
#
# gene omf mfp abc mfp abc gspd omf omf gspF
# gene id 01360 01361 01397 01398 01399 01400 01506 01548 02599
# pos 2 3 11 12 13 14 23 32 46
# clst [ML M ] [M M M ME] [ML] [ML] [ML]
# syst [abc mfp abc gspd omf] with equivalent for omf23 [omf32, gspF46]
# score 1 1 0 0 .7 = 2.7
# gspF46 have a score (465.3). omf (90, 111.5, 87) but it's an exhangeable so it canot be the "best loner"
expected_result_dir = self.find_data("functional_test_ordered_1_cluster_3_loners_w_exchangeable")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-loner-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_multi_loci(self):
# genetic organization of test_4.fasta
#
# gene abc mfp abc gspd omf omf
# gene id 01397 01398 01399 01400 01548 01562
# pos 6 7 14 15 26 40
# clst [M A] [M ME]
# 1 syst [abc6, mfp7 abc14, gspd15]
# score 1 .5 1 .7 = 1.5 + 1.7 = 3.2 - (1 * 1.5 redundancy penalty) = 2.7
# in T12SS-simple-exch omf is not a loner
expected_result_dir = self.find_data("functional_test_ordered_multi_loci")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
"--multi-loci functional/T12SS-simple-exch " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_single_loci(self):
# genetic organization of test_4.fasta
#
# gene abc mfp abc gspd omf omf
# gene id 01397 01398 01399 01400 01548 01562
# pos 6 7 14 15 26 40
# clst [M A] [M ME]
# syst no system
expected_result_dir = self.find_data("functional_test_ordered_single_loci")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_multi_system(self):
# genetic organization of test_13.fasta
#
# gene abc mfp gspd omf gspf abc omf gspd omf
# gene id 01397 01398 01400 01360 02599 01399 01506 00409 01562
# pos 8 9 19 20 21 34 35 36 43
# clst [ M A ] [ M M_MS A ] [M M_MS M]
# syst 1 [gspd19, omf20, gspf21][abc34, omf35, gspd36]
# score 1 1 .5 = 2.5
# score 1 1 1 = 3.0
# syst 2 [abc8 mfp9] + [omf20]
# score 1 .5 .7 = 2.2
# The multi system is in system
# So it can be used for other clusters to form new occurrence
expected_result_dir = self.find_data("functional_test_ordered_multi_system")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-multisystem " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_multi_system_out_system(self):
# genetic organization of test_12.fasta
#
# gene abc mfp gspd omf omf omf
# gene id 01397 01398 01400 01360 01506 01562
# pos 8 9 19 20 33 39
# clst [ M A ] [ M M_MS ]
# syst no system
# The multi system is not in system
# So it cannot be used to build new systems
expected_result_dir = self.find_data("functional_test_ordered_multi_system_out_system")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-multisystem " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_multi_model(self):
# genetic organization of test_14.fasta
#
# gene omf mfp abc gspd pilB pilW
# gene id 01506 01398 01399 01400 000980 025680
# pos 8 9 10 11 12 13
# clst [ model C ]
# [ model D ]
# syst [omf8, mfp9, abc10, gspd11] model C score = 2.5
# [gspd11, pilB12, pilW13] model D score = 2.0
# gspd is multi_model in C_multi_model and D_multi_model
# So the 2 systems are in the solution
expected_result_dir = self.find_data("functional_test_ordered_multi_model")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional C_multi_model D_multi_model " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_ordered_only_one_multi_model(self):
# genetic organization of test_14.fasta
#
# gene omf mfp abc gspd pilB pilW
# gene id 01506 01398 01399 01400 000980 025680
# pos 8 9 10 11 12 13
# clst [ model C ]
# [ model D ]
# syst [omf8, mfp9, abc10, gspd11] model C score = 2.5
# [gspd11, pilB12, pilW13] model D score = 2.0
# gspd is multi_model in D_multi_model but NOT in C_no_multi_model
# So the 2 systems are excllusive. msf pick the best system for the best solution (sys c score 2.5)
expected_result_dir = self.find_data("functional_test_ordered_only_one_multi_model")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional C_no_multi_model D_multi_model " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_degenerated_systems(self):
# genetic organization of test_4.fasta
#
# gene mfp gspd
# gene id 01398 01400
# pos 7 15
# syst [mfp gspd]
# score [M A ] = 1.5
# inter_gene_max_space="8"
expected_result_dir = self.find_data("functional_test_degenerated_systems")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional degenerated_systems " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_uncomplete_degenerated_systems(self):
# genetic organization of test_4.fasta
#
# gene mfp(Man) gspd(acce)
# gene id 01398 01400
# pos 7 15
# syst mfp
# score [1] = 1
# inter_gene_max_space="5"
expected_result_dir = self.find_data("functional_test_uncomplete_degenerated_systems")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional uncomplete_degenerated_systems " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_2_systems_not_compatible(self):
# genetic organization of test_9.fasta
#
# gene abc mfp gspd omf gspf
# gene id 01397 01398 01400 01506 02599
# pos 9 10 13 15 17
# syst A [abc mfp gspd]
# A A M
# score .5 .5 1 = 2.0
# syst B [gspd omf gspf]
# M A A
# score 1 .5 .5 = 2.0
# 2 systems not compatible (share gspd)
# so 2 solutions
expected_result_dir = self.find_data("functional_test_2_systems_not_compatible")
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional A B " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_unordered(self):
# genetic organization of test_4.fasta
#
# gene abc mfp abc gspd omf omf
# gene id 01397 01398 01399 01400 01548 01562
# pos 6 7 14 15 26 40
# syst abc mfp abc gspd omf omf
expected_result_dir = self.find_data("functional_test_unordered")
args = "--db-type unordered " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_systems_txt,
self.uncomplete_systems):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertFileEqual(expected_result, get_results, comment="#")
def test_unordered_only_forbidden(self):
# genetic organization of test_10.fasta
#
# gene omf
# gene id 01506
# pos 17
# syst no Systems
expected_result_dir = self.find_data("functional_test_unordered_only_forbidden")
args = "--db-type unordered " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-forbidden " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_systems_txt,
self.uncomplete_systems):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertFileEqual(expected_result, get_results, comment="#")
def test_unordered_no_hits(self):
# genetic organization of test_11.fasta
#
# gene
# gene id
# pos
# syst no Systems
expected_result_dir = self.find_data("functional_test_unordered_no_hits")
args = "--db-type unordered " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-forbidden " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
for file_name in (self.all_systems_tsv,
self.all_systems_txt,
self.uncomplete_systems):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertFileEqual(expected_result, get_results, comment="#")
def test_no_sequence(self):
seq_path = self.find_data('base', 'empty.fasta')
args = "--db-type ordered_replicon " \
f"--sequence-db {seq_path} " \
"--replicon-topology circular " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
"--relative-path"
with self.assertRaises(SystemExit):
with self.catch_io(out=True):
self._macsyfinder_run(args)
with open(os.path.join(self.out_dir, 'macsyfinder.log')) as log_file:
log = log_file.readlines()[-1].strip()
self.assertEqual(log,
f"CRITICAL : The sequence-db file '{seq_path}' does not contains sequences.")
def test_index_dir(self):
# genetic organization of test_3.fasta
# gene abc mfp omf omf abc gspd
# gene id 01397 01398 01548 01562 01399 01400
# pos 8 9 19 27 37 38
# clst [ ] [ ]
# syst no system
expected_result_dir = self.find_data("functional_test_ordered_linear")
# TODO how to specify multi_loci = false when multi_loci =True is set in xml
args = "--db-type ordered_replicon " \
"--replicon-topology linear " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
"-o {out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
self._macsyfinder_run(args)
self.assertTrue(os.path.exists(os.path.join(self._index_dir, "test_3.fasta.idx")))
def test_working_dir_exists(self):
args = f"--sequence-db {self.find_data('base', 'one_replicon.fasta')} " \
"--db-type ordered_replicon " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS " \
"-o {out_dir}"
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_working_dir_exists')
os.makedirs(self.out_dir)
open(os.path.join(self.out_dir, 'toto.empty'), 'w').close()
args = args.format(out_dir=self.out_dir)
with self.assertRaises(ValueError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception),
f"'{self.out_dir}' already exists and is not a empty")
def test_working_dir_exists_and_not_dir(self):
args = f"--sequence-db {self.find_data('base', 'one_replicon.fasta')} " \
"--db-type ordered_replicon " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS " \
"-o {out_dir} "
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_working_dir_exists_and_not_dir')
try:
open(self.out_dir, 'w').close()
args = args.format(out_dir=self.out_dir)
with self.assertRaises(ValueError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception),
f"'{self.out_dir}' already exists and is not a directory")
finally:
os.unlink(self.out_dir)
def test_force(self):
# test if msf remove previous results when --force is set
# genetic organization of test_3.fasta
# gene abc mfp omf omf abc gspd
# gene id 01397 01398 01548 01562 01399 01400
# pos 2 3 19 27 37 38
# clst ] [
# syst (abc,2), (mfp,3), (abc,37), (gspd, 38)
# in T12SS-simple-exch omf is not a loner
test_name = "functional_test_ordered_circular"
self.out_dir = os.path.join(self.tmp_dir, f'macsyfinder_{test_name}')
expected_result_dir = self.find_data("functional_test_ordered_circular")
args = "--db-type ordered_replicon " \
"--replicon-topology circular " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS-simple-exch " \
f"-o {self.out_dir} " \
f"--index-dir {self._index_dir} " \
f"--previous-run {expected_result_dir} " \
"--relative-path"
# create non empty out dir
os.makedirs(self.out_dir)
open(os.path.join(self.out_dir, 'FOO'), 'w').close()
# msf should complain about out dir
with self.assertRaises(ValueError):
macsyfinder.main(args=args.split(), loglevel='ERROR')
args += " --force"
# msf should run without complain
macsyfinder.main(args=args.split(), loglevel='ERROR')
for file_name in (self.all_systems_tsv,
self.all_best_solutions,
self.best_solution,
self.loners,
self.multisystems,
self.summary,
self.rejected_candidates_tsv):
with self.subTest(file_name=file_name):
expected_result = self.find_data(expected_result_dir, file_name)
get_results = os.path.join(self.out_dir, file_name)
self.assertTsvEqual(expected_result, get_results, comment="#", tsv_type=file_name)
self.assertFileEqual(self.find_data(expected_result_dir, self.rejected_candidates_txt),
os.path.join(self.out_dir, self.rejected_candidates_txt), comment="#")
def test_no_models(self):
args = f"--sequence-db {self.find_data('base', 'one_replicon.fasta')} " \
"--db-type ordered_replicon " \
f"--models-dir {self.find_data('models')} " \
"-o {out_dir} "
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_no_models')
args = args.format(out_dir=self.out_dir)
with self.catch_io(out=True):
with self.assertRaises(OptionError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception),
"argument --models or --previous-run is required.")
def test_no_seq_db(self):
args = "--db-type ordered_replicon " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS " \
"-o {out_dir} "
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_no_seq_db')
args = args.format(out_dir=self.out_dir)
with self.catch_io(out=True):
with self.assertRaises(OptionError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception),
"argument --sequence-db or --previous-run is required.")
def test_no_db_type(self):
args = f"--sequence-db {self.find_data('base', 'one_replicon.fasta')} " \
f"--models-dir {self.find_data('models')} " \
"-m functional T12SS " \
"-o {out_dir} "
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_no_db_type')
args = args.format(out_dir=self.out_dir)
with self.catch_io(out=True):
with self.assertRaises(OptionError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception),
"argument --db-type or --previous-run is required.")
def test_model_unknown(self):
args = f"--sequence-db {self.find_data('base', 'one_replicon.fasta')} " \
"--db-type ordered_replicon " \
f"--models-dir {self.find_data('models')} " \
"-m functional Unknown_model " \
"--index-dir {out_dir} " \
"-o {out_dir}"
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_model_unkwon')
os.makedirs(self.out_dir)
args = args.format(out_dir=self.out_dir)
with self.assertRaises(ValueError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception),
"Unknown_model does not match with any definitions")
def test_cfg_n_previous_run(self):
args = "--cfg-file foo --previous-run bar " \
"-o {out_dir}"
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_cfg_n_previous_run')
os.makedirs(self.out_dir)
args = args.format(out_dir=self.out_dir)
real_exit = sys.exit
sys.exit = self.fake_exit
try:
with self.catch_io(out=True):
with self.assertRaises(TypeError) as ctx:
macsyfinder.main(args=args.split(), loglevel='ERROR')
self.assertEqual(str(ctx.exception), '2')
finally:
sys.exit = real_exit
def _macsyfinder_run(self, args_tpl):
try:
# get the name of the calling function
test_name = inspect.stack()[1].function
self.out_dir = os.path.join(self.tmp_dir, 'macsyfinder_{}'.format(test_name))
os.makedirs(self.out_dir)
args = args_tpl.format(out_dir=self.out_dir)
# print("\n############################################")
# print(args)
# print("##############################################")
System._id = itertools.count(1)
RejectedCandidate._id = itertools.count(1)
macsyfinder.main(args=args.split(),
loglevel='ERROR'
)
except Exception as err:
import traceback
traceback.print_exc()
print(err)
# keep the directory
i = 0
new_name = self.out_dir + f'_keep_{err.__class__.__name__}_{i}'
while os.path.exists(new_name):
i += 1
new_name = self.out_dir + f'_keep_{err.__class__.__name__}_{i}'
if i > 20:
break
shutil.copytree(self.out_dir, new_name)
shutil.copytree(self._index_dir, os.path.join(new_name, os.path.basename(self._index_dir)))
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