From 8e343d0a3902d202225522be8e9e82f36e39dd81 Mon Sep 17 00:00:00 2001 From: Dave Bunten Date: Wed, 3 Jul 2024 08:09:57 -0600 Subject: [PATCH] Use real AWS S3 data tests and apply related fixes (#212) * remove moto * further remove moto and related * formatting * simplify sources work * simplify sources gathering; fix cloud paths * linting and pytest marking * fix utils path; correct pytest marker * update test * update to add new preset for jump data * linting * add scheduled test specificity * find shape * tests for data shape; minor change for parsl conf * testing gh actions tests * custom testing for large data tests * docs updates; lower chunk size * smaller chunk size * updates for profiling * avoid fail fast; increase test chunk size * remove explain * reduce chunk size * attempt hte * join false for s3 sqlite * no join with threaded * split tests; duckdb mem limit * update parsl * chunk size 2000 * chunk size 1000 * 8gb duckdb memory * remove concat test * 800 chunk size * remove duckdb mem limit; update ddb + pa * try unsorted * avoid large data copies in joins * sort output * chunk size 1000 * sort output and remove setting * chunk size 3000 * readd proper data changes * avoid column removal * chunk size 5000; readd col removal * 7000 chunk size * 10000 chunksize * chunk size 15000 * 20000 chunksize * chunksize 30000 * chunk size 45000 * chunksize 40000 * chunksize 35000 * chunk size 30000, scoping for test data * use tmp_path * chunk size 31000 * add test cytominer-database cmd * poetry env context for cytominer-database * show command * use static data for cytominer-database * provide unique paths for test * create temp dependency for testing * try threaded tests * attempt without temp dir * readd temp dir * show sql * resolve path * show sources * move test files * show more about sources * show sources without conditional * add missing files * remove debug; move tests * fix ci conditional * lines cleanup; remove httpfs install * testing comments * revert to cloudpathlib ^0.18.0 * update lockfile * prepare test ci for pr * split test jobs * remove large data tests from matrix * linting * remove dev branch * correct comments; ci job dep * avoid httpfs plugin error * comment about task event trigger Co-Authored-By: Gregory Way * comment about object storage path Co-Authored-By: Gregory Way * limit join data for tests * linting --------- Co-authored-by: Gregory Way --- .github/workflows/test.yml | 26 +- cytotable/convert.py | 29 +- cytotable/presets.py | 48 + cytotable/sources.py | 61 +- cytotable/utils.py | 19 +- docs/source/python-api.md | 16 - poetry.lock | 1223 +++-------------- pyproject.toml | 6 +- tests/conftest.py | 169 +-- .../cytominer-database/data_a/1/Cells.csv | 21 + .../cytominer-database/data_a/1/Cytoplasm.csv | 21 + .../cytominer-database/data_a/1/Nuclei.csv | 21 + .../cytominer-database/data_a/2/Cells.csv | 21 + .../cytominer-database/data_a/2/Cytoplasm.csv | 21 + .../cytominer-database/data_a/2/Nuclei.csv | 21 + .../data_a_sqlite/data_a.sqlite | Bin 0 -> 602112 bytes .../data_b_sqlite/data_b.sqlite | Bin 0 -> 716800 bytes tests/test_convert.py | 22 +- tests/test_convert_threaded.py | 186 +-- tests/test_sources.py | 46 + 20 files changed, 607 insertions(+), 1370 deletions(-) create mode 100644 tests/data/cytominer-database/data_a/1/Cells.csv create mode 100644 tests/data/cytominer-database/data_a/1/Cytoplasm.csv create mode 100644 tests/data/cytominer-database/data_a/1/Nuclei.csv create mode 100644 tests/data/cytominer-database/data_a/2/Cells.csv create mode 100644 tests/data/cytominer-database/data_a/2/Cytoplasm.csv create mode 100644 tests/data/cytominer-database/data_a/2/Nuclei.csv create mode 100644 tests/data/cytominer-database/data_a_sqlite/data_a.sqlite create mode 100644 tests/data/cytominer-database/data_b_sqlite/data_b.sqlite create mode 100644 tests/test_sources.py diff --git a/.github/workflows/test.yml b/.github/workflows/test.yml index 69d41241..adc37c5b 100644 --- a/.github/workflows/test.yml +++ b/.github/workflows/test.yml @@ -24,13 +24,14 @@ jobs: - name: Checkout uses: actions/checkout@v4 - name: Python setup - uses: actions/setup-python@v4 + uses: actions/setup-python@v5 with: python-version: ${{ matrix.python_version }} # remove poetry.lock file for scheduled tests # to help simulate possible upstream issues - name: Remove poetry.lock for scheduled tests - if: github.event_name == 'schedule' + # runs every Wednesday at 7 AM UTC + if: github.event.schedule == '0 7 * * 3' run: | rm poetry.lock - name: Setup for poetry @@ -40,4 +41,23 @@ jobs: - name: Run sphinx-docs build test run: poetry run sphinx-build docs/source doctest -W - name: Run pytest - run: poetry run pytest + run: poetry run pytest -m "not large_data_tests" + # run large data tests as a separate job to help + # conserve resources by detecting failure with + # smaller tests first. + run_large_data_tests: + runs-on: ubuntu-22.04 + needs: run_tests + steps: + - name: Checkout + uses: actions/checkout@v4 + - name: Python setup + uses: actions/setup-python@v5 + with: + python-version: "3.11" + - name: Setup for poetry + uses: ./.github/actions/setup-poetry + - name: Install environment + run: poetry install --no-interaction --no-ansi + - name: Run pytest for large data tests + run: poetry run pytest -m "large_data_tests" diff --git a/cytotable/convert.py b/cytotable/convert.py index c0d782c5..a6e3e267 100644 --- a/cytotable/convert.py +++ b/cytotable/convert.py @@ -46,11 +46,12 @@ def _get_table_columns_and_types( import pathlib import duckdb + from cloudpathlib import AnyPath from cytotable.utils import _duckdb_reader, _sqlite_mixed_type_query_to_parquet source_path = source["source_path"] - source_type = str(pathlib.Path(source_path).suffix).lower() + source_type = str(source_path.suffix).lower() # prepare the data source in the form of a duckdb query select_source = ( @@ -209,7 +210,7 @@ def _get_table_chunk_offsets( import pathlib import duckdb - from cloudpathlib import AnyPath + from cloudpathlib import AnyPath, CloudPath from cytotable.exceptions import NoInputDataException from cytotable.utils import _duckdb_reader @@ -219,18 +220,9 @@ def _get_table_chunk_offsets( if source is not None: table_name = source["table_name"] if "table_name" in source.keys() else None source_path = source["source_path"] - source_type = str(pathlib.Path(source_path).suffix).lower() + source_type = str(source_path.suffix).lower() try: - # for csv's, check that we have more than one row (a header and data values) - if ( - source_type == ".csv" - and sum(1 for _ in AnyPath(source_path).open("r")) <= 1 - ): - raise NoInputDataException( - f"Data file has 0 rows of values. Error in file: {source_path}" - ) - # gather the total rowcount from csv or sqlite data input sources with _duckdb_reader() as ddb_reader: rowcount = int( @@ -322,8 +314,8 @@ def _source_chunk_to_parquet( # attempt to build dest_path source_dest_path = ( - f"{dest_path}/{str(pathlib.Path(source_group_name).stem).lower()}/" - f"{str(pathlib.Path(source['source_path']).parent.name).lower()}" + f"{dest_path}/{str(AnyPath(source_group_name).stem).lower()}/" + f"{str(source['source_path'].parent.name).lower()}" ) pathlib.Path(source_dest_path).mkdir(parents=True, exist_ok=True) @@ -364,11 +356,11 @@ def _source_chunk_to_parquet( # build output query and filepath base # (chunked output will append offset to keep output paths unique) - if str(AnyPath(source["source_path"]).suffix).lower() == ".csv": + if str(source["source_path"].suffix).lower() == ".csv": base_query = f"SELECT {select_columns} FROM read_csv_auto('{str(source['source_path'])}', header=TRUE, delim=',')" result_filepath_base = f"{source_dest_path}/{str(source['source_path'].stem)}" - elif str(AnyPath(source["source_path"]).suffix).lower() == ".sqlite": + elif str(source["source_path"].suffix).lower() == ".sqlite": base_query = f"SELECT {select_columns} FROM sqlite_scan('{str(source['source_path'])}', '{str(source['table_name'])}')" result_filepath_base = f"{source_dest_path}/{str(source['source_path'].stem)}.{source['table_name']}" @@ -405,7 +397,7 @@ def _source_chunk_to_parquet( # to handle the mixed types if ( "Mismatch Type Error" in str(e) - and str(AnyPath(source["source_path"]).suffix).lower() == ".sqlite" + and str(source["source_path"].suffix).lower() == ".sqlite" ): _write_parquet_table_with_metadata( # here we use sqlite instead of duckdb to extract @@ -817,6 +809,7 @@ def _join_source_chunk( exclude_meta_cols = [ f"c NOT LIKE '{col}%'" for col in list(CYOTABLE_META_COLUMN_TYPES.keys()) ] + with _duckdb_reader() as ddb_reader: result = ddb_reader.execute( f""" @@ -1114,7 +1107,7 @@ def _to_parquet( # pylint: disable=too-many-arguments, too-many-locals else [] ), **kwargs, - ).result() + ) # expand the destination path expanded_dest_path = _expand_path(path=dest_path) diff --git a/cytotable/presets.py b/cytotable/presets.py index 4f4191a5..c53e9589 100644 --- a/cytotable/presets.py +++ b/cytotable/presets.py @@ -85,6 +85,54 @@ AND per_nuclei.Nuclei_Number_Object_Number = per_cytoplasm.Cytoplasm_Parent_Nuclei """, }, + "cellprofiler_sqlite_cpg0016_jump": { + # version specifications using related references + "CONFIG_SOURCE_VERSION": { + "cellprofiler": "v4.0.0", + }, + # names of source table compartments (for ex. cells.csv, etc.) + "CONFIG_NAMES_COMPARTMENTS": ("cells", "nuclei", "cytoplasm"), + # names of source table metadata (for ex. image.csv, etc.) + "CONFIG_NAMES_METADATA": ("image",), + # column names in any compartment or metadata tables which contain + # unique names to avoid renaming + "CONFIG_IDENTIFYING_COLUMNS": ( + "ImageNumber", + "ObjectNumber", + "Metadata_Well", + "Metadata_Plate", + "Parent_Cells", + "Parent_Nuclei", + ), + # chunk size to use for join operations to help with possible performance issues + # note: this number is an estimate and is may need changes contingent on data + # and system used by this library. + "CONFIG_CHUNK_SIZE": 1000, + # compartment and metadata joins performed using DuckDB SQL + # and modified at runtime as needed + "CONFIG_JOINS": """ + SELECT + image.Image_TableNumber, + image.Metadata_ImageNumber, + image.Metadata_Plate, + image.Metadata_Well, + image.Image_Metadata_Site, + image.Image_Metadata_Row, + cytoplasm.* EXCLUDE (Metadata_ImageNumber), + cells.* EXCLUDE (Metadata_ImageNumber), + nuclei.* EXCLUDE (Metadata_ImageNumber) + FROM + read_parquet('cytoplasm.parquet') AS cytoplasm + LEFT JOIN read_parquet('cells.parquet') AS cells ON + cells.Metadata_ImageNumber = cytoplasm.Metadata_ImageNumber + AND cells.Metadata_ObjectNumber = cytoplasm.Cytoplasm_Parent_Cells + LEFT JOIN read_parquet('nuclei.parquet') AS nuclei ON + nuclei.Metadata_ImageNumber = cytoplasm.Metadata_ImageNumber + AND nuclei.Metadata_ObjectNumber = cytoplasm.Cytoplasm_Parent_Nuclei + LEFT JOIN read_parquet('image.parquet') AS image ON + image.Metadata_ImageNumber = cytoplasm.Metadata_ImageNumber + """, + }, "cellprofiler_sqlite_pycytominer": { # version specifications using related references "CONFIG_SOURCE_VERSION": { diff --git a/cytotable/sources.py b/cytotable/sources.py index 0c4238ba..8e3276d3 100644 --- a/cytotable/sources.py +++ b/cytotable/sources.py @@ -7,13 +7,11 @@ from typing import Any, Dict, List, Optional, Union from cloudpathlib import AnyPath -from parsl.app.app import join_app, python_app +from cytotable.exceptions import NoInputDataException -@python_app -def _build_path( - path: Union[str, pathlib.Path, AnyPath], **kwargs -) -> Union[pathlib.Path, AnyPath]: + +def _build_path(path: str, **kwargs) -> Union[pathlib.Path, AnyPath]: """ Build a path client or return local path. @@ -43,10 +41,9 @@ def _build_path( return processed_path -@python_app def _get_source_filepaths( path: Union[pathlib.Path, AnyPath], - targets: List[str], + targets: Optional[List[str]] = None, source_datatype: Optional[str] = None, ) -> Dict[str, List[Dict[str, Any]]]: """ @@ -75,7 +72,7 @@ def _get_source_filepaths( if (targets is None or targets == []) and source_datatype is None: raise DatatypeException( - f"A source_datatype must be specified when using undefined compartments and metadata names." + "A source_datatype must be specified when using undefined compartments and metadata names." ) # gathers files from provided path using compartments + metadata as a filter @@ -87,9 +84,9 @@ def _get_source_filepaths( for subpath in ( (path,) # used if the source path is a single file - if AnyPath(path).is_file() + if path.is_file() # iterates through a source directory - else (x for x in AnyPath(path).glob("**/*") if AnyPath(x).is_file()) + else (x for x in path.glob("**/*") if x.is_file()) ) # ensure the subpaths meet certain specifications if ( @@ -129,7 +126,8 @@ def _get_source_filepaths( .arrow()["table_name"] .to_pylist() # make sure the table names match with compartment + metadata names - if any(target.lower() in table_name.lower() for target in targets) + if targets is not None + and any(target.lower() in table_name.lower() for target in targets) ] else: # if we don't have sqlite source, append the existing element @@ -181,7 +179,6 @@ def _get_source_filepaths( return grouped_sources -@python_app def _infer_source_datatype( sources: Dict[str, List[Dict[str, Any]]], source_datatype: Optional[str] = None ) -> str: @@ -230,7 +227,6 @@ def _infer_source_datatype( return source_datatype -@python_app def _filter_source_filepaths( sources: Dict[str, List[Dict[str, Any]]], source_datatype: str ) -> Dict[str, List[Dict[str, Any]]]: @@ -260,12 +256,45 @@ def _filter_source_filepaths( if file["source_path"].stat().st_size > 0 # ensure the datatype matches the source datatype and file["source_path"].suffix == f".{source_datatype}" + and _file_is_more_than_one_line(path=file["source_path"]) ] for filegroup, files in sources.items() } -@join_app +def _file_is_more_than_one_line(path: Union[pathlib.Path, AnyPath]) -> bool: + """ + Check if the file has more than one line. + + Args: + path (Union[pathlib.Path, AnyPath]): + The path to the file. + + Returns: + bool: + True if the file has more than one line, False otherwise. + + Raises: + NoInputDataException: If the file has zero lines. + """ + + # if we don't have a sqlite file + # (we can't check sqlite files for lines) + if path.suffix.lower() != ".sqlite": + with path.open("r") as f: + try: + # read two lines, if the second is empty return false + return bool(f.readline() and f.readline()) + + except StopIteration: + # If we encounter the end of the file, it has only one line + raise NoInputDataException( + f"Data file has 0 rows of values. Error in file: {path}" + ) + else: + return True + + def _gather_sources( source_path: str, source_datatype: Optional[str] = None, @@ -295,11 +324,11 @@ def _gather_sources( _infer_source_datatype, ) - source_path = _build_path(path=source_path, **kwargs) + built_path = _build_path(path=source_path, **kwargs) # gather filepaths which will be used as the basis for this work sources = _get_source_filepaths( - path=source_path, targets=targets, source_datatype=source_datatype + path=built_path, targets=targets, source_datatype=source_datatype ) # infer or validate the source datatype based on source filepaths diff --git a/cytotable/utils.py b/cytotable/utils.py index 62972b96..c95d4fb7 100644 --- a/cytotable/utils.py +++ b/cytotable/utils.py @@ -149,6 +149,10 @@ def _duckdb_reader() -> duckdb.DuckDBPyConnection: INSTALL sqlite_scanner; LOAD sqlite_scanner; + /* Install httpfs plugin to avoid error + https://github.com/duckdb/duckdb/issues/3243 */ + INSTALL httpfs; + /* Set threads available to duckdb See the following for more information: @@ -322,7 +326,7 @@ def _sqlite_affinity_data_type_lookup(col_type: str) -> str: return pa.Table.from_pylist(results) -def _cache_cloudpath_to_local(path: Union[str, AnyPath]) -> pathlib.Path: +def _cache_cloudpath_to_local(path: AnyPath) -> pathlib.Path: """ Takes a cloudpath and uses cache to convert to a local copy for use in scenarios where remote work is not possible (sqlite). @@ -337,24 +341,25 @@ def _cache_cloudpath_to_local(path: Union[str, AnyPath]) -> pathlib.Path: A local pathlib.Path to cached version of cloudpath file. """ - candidate_path = AnyPath(path) - # check that the path is a file (caching won't work with a dir) # and check that the file is of sqlite type # (other file types will be handled remotely in cloud) - if candidate_path.is_file() and candidate_path.suffix.lower() == ".sqlite": + if ( + isinstance(path, CloudPath) + and path.is_file() + and path.suffix.lower() == ".sqlite" + ): try: # update the path to be the local filepath for reference in CytoTable ops # note: incurs a data read which will trigger caching of the file - path = CloudPath(path).fspath + path = pathlib.Path(path.fspath) except InvalidPrefixError: # share information about not finding a cloud path logger.info( "Did not detect a cloud path based on prefix. Defaulting to use local path operations." ) - # cast the result as a pathlib.Path - return pathlib.Path(path) + return path def _arrow_type_cast_if_specified( diff --git a/docs/source/python-api.md b/docs/source/python-api.md index e67952a2..7868f2c7 100644 --- a/docs/source/python-api.md +++ b/docs/source/python-api.md @@ -64,22 +64,6 @@ Sources | -.. autofunction:: _build_path - -| - -.. autofunction:: _filter_source_filepaths - -| - -.. autofunction:: _get_source_filepaths - -| - -.. autofunction:: _infer_source_datatype - -| - Utils ----- diff --git a/poetry.lock b/poetry.lock index 34da1cd4..80363dff 100644 --- a/poetry.lock +++ b/poetry.lock @@ -1,4 +1,4 @@ -# This file is automatically @generated by Poetry 1.8.2 and should not be changed by hand. +# This file is automatically @generated by Poetry 1.8.3 and should not be changed by hand. [[package]] name = "agate" @@ -90,74 +90,6 @@ files = [ {file = "alabaster-0.7.13.tar.gz", hash = "sha256:a27a4a084d5e690e16e01e03ad2b2e552c61a65469419b907243193de1a84ae2"}, ] -[[package]] -name = "annotated-types" -version = "0.6.0" -description = "Reusable constraint types to use with typing.Annotated" -optional = false -python-versions = ">=3.8" -files = [ - {file = "annotated_types-0.6.0-py3-none-any.whl", hash = "sha256:0641064de18ba7a25dee8f96403ebc39113d0cb953a01429249d5c7564666a43"}, - {file = "annotated_types-0.6.0.tar.gz", hash = "sha256:563339e807e53ffd9c267e99fc6d9ea23eb8443c08f112651963e24e22f84a5d"}, -] - -[package.dependencies] -typing-extensions = {version = ">=4.0.0", markers = "python_version < \"3.9\""} - -[[package]] -name = "attrs" -version = "23.2.0" -description = "Classes Without Boilerplate" -optional = false -python-versions = ">=3.7" -files = [ - {file = "attrs-23.2.0-py3-none-any.whl", hash = "sha256:99b87a485a5820b23b879f04c2305b44b951b502fd64be915879d77a7e8fc6f1"}, - {file = "attrs-23.2.0.tar.gz", hash = "sha256:935dc3b529c262f6cf76e50877d35a4bd3c1de194fd41f47a2b7ae8f19971f30"}, -] - -[package.extras] -cov = ["attrs[tests]", "coverage[toml] (>=5.3)"] -dev = ["attrs[tests]", "pre-commit"] -docs = ["furo", "myst-parser", "sphinx", "sphinx-notfound-page", "sphinxcontrib-towncrier", "towncrier", "zope-interface"] -tests = ["attrs[tests-no-zope]", "zope-interface"] -tests-mypy = ["mypy (>=1.6)", "pytest-mypy-plugins"] -tests-no-zope = ["attrs[tests-mypy]", "cloudpickle", "hypothesis", "pympler", "pytest (>=4.3.0)", "pytest-xdist[psutil]"] - -[[package]] -name = "aws-sam-translator" -version = "1.86.0" -description = "AWS SAM Translator is a library that transform SAM templates into AWS CloudFormation templates" -optional = false -python-versions = ">=3.8, <=4.0, !=4.0" -files = [ - {file = "aws-sam-translator-1.86.0.tar.gz", hash = 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for Python (the SDK) enables Python developers to record and emit information from within their applications to the AWS X-Ray service." -optional = false -python-versions = ">=3.7" -files = [ - {file = "aws-xray-sdk-2.13.0.tar.gz", hash = "sha256:816186126917bc35ae4e6e2f304702a43d494ecef34a39e6330f5018bdecc9f5"}, - {file = "aws_xray_sdk-2.13.0-py2.py3-none-any.whl", hash = "sha256:d18604a8688b4bed03ce4a858cc9acd72b71400e085bf7512fc31cf657ca85f9"}, -] - -[package.dependencies] -botocore = ">=1.11.3" -wrapt = "*" - [[package]] name = "azure-core" version = "1.30.1" @@ -280,16 +212,21 @@ tests = ["pytest (>=3.2.1,!=3.3.0)"] typecheck = ["mypy"] [[package]] -name = "blinker" -version = "1.7.0" -description = "Fast, simple object-to-object and broadcast signaling" +name = "boto3" +version = "1.7.84" +description = "The AWS SDK for Python" optional = false -python-versions = ">=3.8" +python-versions = "*" files = [ - {file = "blinker-1.7.0-py3-none-any.whl", hash = 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b/pyproject.toml @@ -25,7 +25,7 @@ build-backend = "poetry_dynamic_versioning.backend" [tool.poetry.dependencies] python = ">=3.8,<3.13" pyarrow = ">=13.0.0" -cloudpathlib = {extras = ["all"], version = "^0.18.0"} +cloudpathlib = {extras = ["all", "s3"], version = "^0.18.0"} duckdb = ">=0.8.0,!=0.10.0,>=0.10.1" parsl = ">=2023.9.25" numpy = [ @@ -43,7 +43,6 @@ pytest-cov = "^4.1.0" Sphinx = "^6.0.0" myst-parser = "^2.0.0" sphinxcontrib-mermaid = "^0.9.0" -moto = {extras = ["s3", "server"], version = "^4.0.0"} cytominer-database = "^0.3.4" pycytominer = "^1.1.0" dunamai = "^1.19.0" @@ -69,3 +68,6 @@ filterwarnings = [ "ignore::DeprecationWarning:pkg_resources", "ignore::DeprecationWarning:cytominer_database", ] +markers = [ + "large_data_tests: tests which involve the use of large data.", +] diff --git a/tests/conftest.py b/tests/conftest.py index 8323af21..43d1fbe5 100644 --- a/tests/conftest.py +++ b/tests/conftest.py @@ -6,22 +6,16 @@ import pathlib import shutil -import socket import sqlite3 import subprocess import tempfile -from contextlib import closing from typing import Any, Dict, Generator, List, Tuple -import boto3 -import boto3.session import duckdb import pandas as pd import parsl import pyarrow as pa import pytest -from moto import mock_s3 -from moto.server import ThreadedMotoServer from parsl.config import Config from parsl.executors import ThreadPoolExecutor from pyarrow import csv, parquet @@ -58,10 +52,6 @@ def fixture_load_parsl_threaded(clear_parsl_config: None) -> None: See the following for more details. https://parsl.readthedocs.io/en/stable/stubs/parsl.executors.ThreadPoolExecutor.html - - Note: we use the threadpoolexecutor in some occasions to avoid issues - with multiprocessing in moto / mocked S3 environments. - See here for more: https://docs.getmoto.org/en/latest/docs/faq.html#is-moto-concurrency-safe """ parsl.load( @@ -149,9 +139,12 @@ def fixture_data_dir_in_carta() -> List[str]: return [f"{pathlib.Path(__file__).parent}/data/in-carta/colas-lab"] -@pytest.fixture(name="cytominerdatabase_sqlite") +# skip this fixture to avoid issues with ubuntu 22.04 and CLI usage of +# cytominer-database. Use instead fixture cytominerdatabase_sqlite_static. +@pytest.mark.skip +@pytest.fixture(name="cytominerdatabase_sqlite", scope="function") def fixture_cytominerdatabase_sqlite( - fx_tempdir: str, + tmp_path: str, data_dirs_cytominerdatabase: List[str], ) -> List[str]: """ @@ -162,11 +155,11 @@ def fixture_cytominerdatabase_sqlite( for data_dir in data_dirs_cytominerdatabase: # example command for reference as subprocess below # cytominer-database ingest source_directory sqlite:///backend.sqlite -c ingest_config.ini - output_path = f"sqlite:///{fx_tempdir}/{pathlib.Path(data_dir).name}.sqlite" + output_path = f"sqlite:///{data_dir}/{pathlib.Path(data_dir).name}.sqlite" # run cytominer-database as command-line call subprocess.call( - [ + args=[ "cytominer-database", "ingest", data_dir, @@ -175,16 +168,29 @@ def fixture_cytominerdatabase_sqlite( f"{data_dir}/config_SQLite.ini", ] ) + # store the sqlite output file within list to be returned output_paths.append(output_path) return output_paths +@pytest.fixture(name="cytominerdatabase_sqlite_static", scope="function") +def fixture_cytominerdatabase_sqlite_static(): + """ + Fixture for returning pre-created cytominer-database SQLite files which + align to what was created from fixture_cytominerdatabase_sqlite. + """ + return [ + f"sqlite:///{pathlib.Path(__file__).parent.resolve()}/data/cytominer-database/data_a_sqlite/data_a.sqlite", + f"sqlite:///{pathlib.Path(__file__).parent.resolve()}/data/cytominer-database/data_b_sqlite/data_b.sqlite", + ] + + @pytest.fixture() def cytominerdatabase_to_pycytominer_merge_single_cells_parquet( fx_tempdir: str, - cytominerdatabase_sqlite: List[str], + cytominerdatabase_sqlite_static: List[str], ) -> List[str]: """ Processed cytominer-database test sqlite data as @@ -192,7 +198,7 @@ def cytominerdatabase_to_pycytominer_merge_single_cells_parquet( """ output_paths = [] - for sqlite_file in cytominerdatabase_sqlite: + for sqlite_file in cytominerdatabase_sqlite_static: # build SingleCells from database and merge single cells into parquet file output_paths.append( SingleCells( @@ -629,108 +635,6 @@ def fixture_cytominerdatabase_merged_cellhealth( return control_result -@pytest.fixture(scope="session", name="infer_open_port") -def fixture_infer_open_port() -> int: - """ - Infers an open port for use with tests. - """ - - # Referenced with modifications from https://stackoverflow.com/a/45690594/22216869. - # Note: this implementation opens, temporarily uses an available port, and returns - # that same port for use in tests. The contextlib.closing context relieves the use - # of the returned available port. - - # Context for a socket which is opened and automatically closed - # using family=AF_INET (internet address family socket default) - # and type=SOCK_STREAM (a socket stream) - with closing( - socket.socket(family=socket.AF_INET, type=socket.SOCK_STREAM) - ) as open_socket: - # Bind the socket to address of format (hostname, port), - # in this case, localhost and port 0. - # Using 0 indicates to use an available open port for this work. - # see: https://docs.python.org/3/library/socket.html#socket-families - open_socket.bind(("localhost", 0)) - - # Set the value of 1 to SO_REUSEADDR as a socket option. - # see bottom of: https://docs.python.org/3/library/socket.html - # "The SO_REUSEADDR flag tells the kernel to reuse a local socket in TIME_WAIT state, - # without waiting for its natural timeout to expire." - open_socket.setsockopt(socket.SOL_SOCKET, socket.SO_REUSEADDR, 1) - - # Return the port value of the socket address of format (hostname, port). - return open_socket.getsockname()[1] - - -@pytest.fixture(scope="session", name="s3_session") -def fixture_s3_session( - infer_open_port: int, -) -> Generator[Tuple[boto3.session.Session, int], None, None]: - """ - Yield a mocked boto session for s3 tests. - Return includes port related to session. - - Referenced from: - https://docs.getmoto.org/en/latest/docs/getting_started.html - and - https://docs.getmoto.org/en/latest/docs/server_mode.html#start-within-python - """ - - # start a moto server for use in testing - server = ThreadedMotoServer(port=infer_open_port) - server.start() - - with mock_s3(): - yield boto3.session.Session(), infer_open_port - - -@pytest.fixture() -def example_s3_endpoint( - s3_session: Tuple[boto3.session.Session, int], - example_local_sources: Dict[str, List[Dict[str, Any]]], - data_dir_cellprofiler_sqlite_nf1: str, -) -> str: - """ - Create an mocked bucket which includes example sources - - Referenced with changes from: - https://docs.getmoto.org/en/latest/docs/getting_started.html - """ - # s3 is a fixture defined above that yields a boto3 s3 client. - endpoint_url = f"http://localhost:{s3_session[1]}" - bucket_name = "example" - - # create s3 client - s3_client = s3_session[0].client("s3", endpoint_url=endpoint_url) - - # create a bucket for content to land in - s3_client.create_bucket(Bucket=bucket_name) - - # upload each example file to the mock bucket - for source_path in [ - source["source_path"] - for group in example_local_sources.values() - for source in group - ]: - s3_client.upload_file( - Filename=str(source_path), - Bucket=bucket_name, - # mock nested directory structure within bucket per each file's parent - Key=f"{source_path.parent.name}/{source_path.name}", - ) - - # upload sqlite example - s3_client.upload_file( - Filename=data_dir_cellprofiler_sqlite_nf1, - Bucket=bucket_name, - # mock nested directory structure within bucket - Key=f"nf1/{pathlib.Path(data_dir_cellprofiler_sqlite_nf1).name}", - ) - - # return endpoint url for use in testing - return endpoint_url - - @pytest.fixture() def example_sqlite_mixed_types_database( fx_tempdir: str, @@ -792,3 +696,32 @@ def example_sqlite_mixed_types_database( finally: # after completing the tests, remove the file pathlib.Path(filepath).unlink() + + +@pytest.fixture(name="example_s3_path_csv_jump") +def fixture_example_s3_path_csv_jump() -> str: + """ + Provides an example s3 endpoint for use with tests. + + This points to an object storage directory which includes CSV files + related to processing within CytoTable. For example, image.csv, + nuclei.csv, cytoplasm.csv, cells.csv, etc. + """ + + return ( + "s3://cellpainting-gallery/cpg0000-jump-pilot/source_4/" + "workspace/analysis/2020_11_04_CPJUMP1/BR00116991/analysis/BR00116991-A01-1" + ) + + +@pytest.fixture(scope="session", name="example_s3_path_sqlite_jump") +def fixture_example_s3_path() -> str: + """ + Provides an example s3 endpoint for use with tests + """ + + return ( + "s3://cellpainting-gallery/cpg0016-jump/source_4/" + "workspace/backend/2021_08_23_Batch12/BR00126114" + "/BR00126114.sqlite" + ) diff --git a/tests/data/cytominer-database/data_a/1/Cells.csv b/tests/data/cytominer-database/data_a/1/Cells.csv new file mode 100644 index 00000000..96f6f11b --- /dev/null +++ b/tests/data/cytominer-database/data_a/1/Cells.csv @@ -0,0 +1,21 @@ 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diff --git a/tests/data/cytominer-database/data_a/1/Cytoplasm.csv b/tests/data/cytominer-database/data_a/1/Cytoplasm.csv new file mode 100644 index 00000000..ff4e6045 --- /dev/null +++ b/tests/data/cytominer-database/data_a/1/Cytoplasm.csv @@ -0,0 +1,21 @@ 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diff --git a/tests/data/cytominer-database/data_a/1/Nuclei.csv b/tests/data/cytominer-database/data_a/1/Nuclei.csv new file mode 100644 index 00000000..fd2335ec --- /dev/null +++ b/tests/data/cytominer-database/data_a/1/Nuclei.csv @@ -0,0 +1,21 @@ 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diff --git a/tests/data/cytominer-database/data_a/2/Cells.csv b/tests/data/cytominer-database/data_a/2/Cells.csv new file mode 100644 index 00000000..8eaeebcc --- /dev/null +++ b/tests/data/cytominer-database/data_a/2/Cells.csv @@ -0,0 +1,21 @@ 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diff --git a/tests/data/cytominer-database/data_a/2/Cytoplasm.csv b/tests/data/cytominer-database/data_a/2/Cytoplasm.csv new file mode 100644 index 00000000..5269eb73 --- /dev/null +++ b/tests/data/cytominer-database/data_a/2/Cytoplasm.csv @@ -0,0 +1,21 @@ 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diff --git a/tests/data/cytominer-database/data_a/2/Nuclei.csv b/tests/data/cytominer-database/data_a/2/Nuclei.csv new file mode 100644 index 00000000..1aebb059 --- /dev/null +++ b/tests/data/cytominer-database/data_a/2/Nuclei.csv @@ -0,0 +1,21 @@ 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with pytest.raises(Exception): - _infer_source_datatype(sources=data, source_datatype="parquet").result() + _infer_source_datatype(sources=data, source_datatype="parquet") data["sample_3.parquet"] = [{"source_path": "stub"}] - assert ( - _infer_source_datatype(sources=data, source_datatype="parquet").result() - == "parquet" - ) + assert _infer_source_datatype(sources=data, source_datatype="parquet") == "parquet" with pytest.raises(Exception): - _infer_source_datatype(sources=data).result() + _infer_source_datatype(sources=data) def test_to_parquet( @@ -751,9 +748,11 @@ def test_convert_cytominerdatabase_csv( csvs from cytominer-database to pycytominer merge_single_cells """ - for cytominerdatabase_dir, pycytominer_merge_dir in zip( - data_dirs_cytominerdatabase, - cytominerdatabase_to_pycytominer_merge_single_cells_parquet, + for idx, (cytominerdatabase_dir, pycytominer_merge_dir) in enumerate( + zip( + data_dirs_cytominerdatabase, + cytominerdatabase_to_pycytominer_merge_single_cells_parquet, + ) ): # load control table, dropping tablenumber # and unlabeled objectnumber (no compartment specified) @@ -780,7 +779,8 @@ def test_convert_cytominerdatabase_csv( source=convert( source_path=cytominerdatabase_dir, dest_path=( - f"{fx_tempdir}/{pathlib.Path(cytominerdatabase_dir).name}.test_table.parquet" + f"{fx_tempdir}/" + f"{pathlib.Path(cytominerdatabase_dir).name}.test_table_{idx}.parquet" ), dest_datatype="parquet", source_datatype="csv", diff --git a/tests/test_convert_threaded.py b/tests/test_convert_threaded.py index 87f44437..baac08bd 100644 --- a/tests/test_convert_threaded.py +++ b/tests/test_convert_threaded.py @@ -6,14 +6,11 @@ import pathlib -from typing import Any, Dict, List, cast -import parsl +import pandas as pd import pyarrow as pa import pyarrow.compute as pc import pytest -from parsl.config import Config -from parsl.executors import ThreadPoolExecutor from pyarrow import parquet from cytotable.convert import convert @@ -54,69 +51,35 @@ def test_convert_tpe_cellprofiler_csv( assert test_result.shape == control_result.shape assert test_result.equals(control_result) - # clean up the parsl config for other tests - parsl.clear() - def test_convert_s3_path_csv( - load_parsl_threaded: None, - fx_tempdir: str, - example_local_sources: Dict[str, List[Dict[str, Any]]], - example_s3_endpoint: str, + load_parsl_threaded: None, fx_tempdir: str, example_s3_path_csv_jump: str ): """ Tests convert with mocked csv s3 object storage endpoint """ - multi_dir_nonconcat_s3_result = convert( - source_path="s3://example/", + s3_result = convert( + source_path=example_s3_path_csv_jump, dest_path=f"{fx_tempdir}/s3_test", dest_datatype="parquet", - concat=False, - join=False, - joins=None, source_datatype="csv", - compartments=["cytoplasm", "cells"], - metadata=["image"], - identifying_columns=["imagenumber"], - # endpoint_url here will be used with cloudpathlib client(**kwargs) - endpoint_url=example_s3_endpoint, - parsl_config=Config( - executors=[ - ThreadPoolExecutor( - label="tpe_for_cytotable_testing_moto_s3", - ) - ] - ), + preset="cellprofiler_csv", + no_sign_request=True, ) - # compare each of the results using files from the source - for control_path, test_path in zip( - [ - source["table"] - for group in cast(Dict, multi_dir_nonconcat_s3_result).values() - for source in group - ], - [ - source["table"] - for group in example_local_sources.values() - for source in group - ], - ): - parquet_control = parquet.ParquetDataset(path_or_paths=control_path).read() - parquet_result = parquet.ParquetDataset( - path_or_paths=test_path, schema=parquet_control.schema - ).read() - - assert parquet_result.schema.equals(parquet_control.schema) - assert parquet_result.shape == parquet_control.shape - - -def test_convert_s3_path_sqlite( + # read only the metadata from parquet file + parquet_file_meta = parquet.ParquetFile(s3_result).metadata + + # check the shape of the data + assert (parquet_file_meta.num_rows, parquet_file_meta.num_columns) == (109, 5794) + + +@pytest.mark.large_data_tests +def test_convert_s3_path_sqlite_join( load_parsl_threaded: None, fx_tempdir: str, - data_dir_cellprofiler_sqlite_nf1: str, - example_s3_endpoint: str, + example_s3_path_sqlite_jump: str, ): """ Tests convert with mocked sqlite s3 object storage endpoint @@ -125,72 +88,55 @@ def test_convert_s3_path_sqlite( race conditions with nested pytest fixture post-yield deletions. """ - # local sqlite read - local_cytotable_table = parquet.read_table( - source=convert( - source_path=data_dir_cellprofiler_sqlite_nf1, - dest_path=( - f"{fx_tempdir}/{pathlib.Path(data_dir_cellprofiler_sqlite_nf1).name}" - ".cytotable.local.parquet" - ), - dest_datatype="parquet", - chunk_size=100, - preset="cellprofiler_sqlite_pycytominer", - ) + s3_result = convert( + source_path=example_s3_path_sqlite_jump, + dest_path=f"{fx_tempdir}/s3_test", + dest_datatype="parquet", + source_datatype="sqlite", + # set chunk size to amount which operates within + # github actions runner images and related resource constraints. + chunk_size=30000, + preset="cellprofiler_sqlite_cpg0016_jump", + no_sign_request=True, + # use explicit cache to avoid temp cache removal / overlaps with + # sequential s3 SQLite files. See below for more information + # https://cloudpathlib.drivendata.org/stable/caching/#automatically + local_cache_dir=f"{fx_tempdir}/sqlite_s3_cache/2", + # note: we use a custom join to limit the + # data processing required within the context + # of GitHub Actions runner image resources. + joins=""" + SELECT + image.Image_TableNumber, + image.Metadata_ImageNumber, + image.Metadata_Plate, + image.Metadata_Well, + image.Image_Metadata_Site, + image.Image_Metadata_Row, + cytoplasm.* EXCLUDE (Metadata_ImageNumber), + cells.* EXCLUDE (Metadata_ImageNumber), + nuclei.* EXCLUDE (Metadata_ImageNumber) + FROM + (SELECT * FROM read_parquet('cytoplasm.parquet') LIMIT 5000) AS cytoplasm + LEFT JOIN (SELECT * FROM read_parquet('cells.parquet') LIMIT 5000) AS cells ON + cells.Metadata_ImageNumber = cytoplasm.Metadata_ImageNumber + AND cells.Metadata_ObjectNumber = cytoplasm.Cytoplasm_Parent_Cells + LEFT JOIN (SELECT * FROM read_parquet('nuclei.parquet') LIMIT 5000) AS nuclei ON + nuclei.Metadata_ImageNumber = cytoplasm.Metadata_ImageNumber + AND nuclei.Metadata_ObjectNumber = cytoplasm.Cytoplasm_Parent_Nuclei + LEFT JOIN (SELECT * FROM read_parquet('image.parquet') LIMIT 5000) AS image ON + image.Metadata_ImageNumber = cytoplasm.Metadata_ImageNumber + """, ) - # s3 sqlite read with single and directly referenced file - s3_cytotable_table = parquet.read_table( - source=convert( - source_path=f"s3://example/nf1/{pathlib.Path(data_dir_cellprofiler_sqlite_nf1).name}", - dest_path=( - f"{fx_tempdir}/{pathlib.Path(data_dir_cellprofiler_sqlite_nf1).name}" - ".cytotable.mocks3.direct.parquet" - ), - dest_datatype="parquet", - chunk_size=100, - preset="cellprofiler_sqlite_pycytominer", - endpoint_url=example_s3_endpoint, - # use explicit cache to avoid temp cache removal / overlaps with - # sequential s3 SQLite files. See below for more information - # https://cloudpathlib.drivendata.org/stable/caching/#automatically - local_cache_dir=f"{fx_tempdir}/sqlite_s3_cache/1", - ) - ) + # read only the metadata from parquet file + parquet_file_meta = parquet.ParquetFile(s3_result).metadata - # s3 sqlite read with nested sqlite file - s3_cytotable_table_nested = parquet.read_table( - source=convert( - source_path="s3://example/nf1/", - dest_path=( - f"{fx_tempdir}/{pathlib.Path(data_dir_cellprofiler_sqlite_nf1).name}" - ".cytotable.mocks3.nested.parquet" - ), - dest_datatype="parquet", - chunk_size=100, - preset="cellprofiler_sqlite_pycytominer", - endpoint_url=example_s3_endpoint, - # use explicit cache to avoid temp cache removal / overlaps with - # sequential s3 SQLite files. See below for more information - # https://cloudpathlib.drivendata.org/stable/caching/#automatically - local_cache_dir=f"{fx_tempdir}/sqlite_s3_cache/2", - ) - ) + # check the shape of the data + assert (parquet_file_meta.num_rows, parquet_file_meta.num_columns) == (5000, 5928) - assert local_cytotable_table.sort_by( - [(name, "ascending") for name in local_cytotable_table.schema.names] - ).equals( - s3_cytotable_table.sort_by( - [(name, "ascending") for name in s3_cytotable_table.schema.names] - ) - ) - assert local_cytotable_table.sort_by( - [(name, "ascending") for name in local_cytotable_table.schema.names] - ).equals( - s3_cytotable_table_nested.sort_by( - [(name, "ascending") for name in s3_cytotable_table_nested.schema.names] - ) - ) + # check that dropping duplicates results in the same shape + assert pd.read_parquet(s3_result).drop_duplicates().shape == (5000, 5928) def test_get_source_filepaths( @@ -207,7 +153,7 @@ def test_get_source_filepaths( single_dir_result = _get_source_filepaths( path=empty_dir, targets=["image", "cells", "nuclei", "cytoplasm"], - ).result() + ) # check that single sqlite file is returned as desired single_file_result = _get_source_filepaths( @@ -215,27 +161,27 @@ def test_get_source_filepaths( f"{data_dir_cellprofiler}/NF1_SchwannCell_data/all_cellprofiler.sqlite" ), targets=["cells"], - ).result() + ) assert len(set(single_file_result.keys())) == 1 # check that single csv file is returned as desired single_file_result = _get_source_filepaths( path=pathlib.Path(f"{data_dir_cellprofiler}/ExampleHuman/Cells.csv"), targets=["cells"], - ).result() + ) assert len(set(single_file_result.keys())) == 1 single_dir_result = _get_source_filepaths( path=pathlib.Path(f"{data_dir_cellprofiler}/ExampleHuman"), targets=["cells"], - ).result() + ) # test that the single dir structure includes 1 unique key (for cells) assert len(set(single_dir_result.keys())) == 1 single_dir_result = _get_source_filepaths( path=pathlib.Path(f"{data_dir_cellprofiler}/ExampleHuman"), targets=["image", "cells", "nuclei", "cytoplasm"], - ).result() + ) # test that the single dir structure includes 4 unique keys assert len(set(single_dir_result.keys())) == 4 diff --git a/tests/test_sources.py b/tests/test_sources.py new file mode 100644 index 00000000..ba7ea620 --- /dev/null +++ b/tests/test_sources.py @@ -0,0 +1,46 @@ +""" +Testing for cytotable/sources.py +""" + +import pathlib +import tempfile + +from cytotable.sources import _file_is_more_than_one_line + + +def test_file_is_more_than_one_line(): + """ + Tests for _file_is_more_than_one_line + """ + # zero lines test + with tempfile.NamedTemporaryFile(delete=False) as tmp_file: + tmp_file_path = pathlib.Path(tmp_file.name) + assert not _file_is_more_than_one_line(tmp_file_path) + tmp_file_path.unlink() + + # test file with one line + with tempfile.NamedTemporaryFile(delete=False, mode="w") as tmp_file: + tmp_file.write("This is the only line in the file.") + tmp_file_path = pathlib.Path(tmp_file.name) + assert not _file_is_more_than_one_line(tmp_file_path) + tmp_file_path.unlink() + + # test file with more than one line + with tempfile.NamedTemporaryFile(delete=False, mode="w") as tmp_file: + tmp_file.write("First line.\nSecond line.") + tmp_file_path = pathlib.Path(tmp_file.name) + assert _file_is_more_than_one_line(tmp_file_path) + tmp_file_path.unlink() + + # test multiple line file + with tempfile.NamedTemporaryFile(delete=False, mode="w") as tmp_file: + tmp_file.write("First line.\nSecond line.\nThird line.") + tmp_file_path = pathlib.Path(tmp_file.name) + assert _file_is_more_than_one_line(tmp_file_path) + tmp_file_path.unlink() + + # test sqlite file + with tempfile.NamedTemporaryFile(delete=False, suffix=".sqlite") as tmp_file: + tmp_file_path = pathlib.Path(tmp_file.name) + assert _file_is_more_than_one_line(tmp_file_path) + tmp_file_path.unlink()