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0.3.2
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0992f0e746
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21
CHANGELOG.md
21
CHANGELOG.md
@@ -2,6 +2,27 @@
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All notable changes to this project will be documented in this file. See [standard-version](https://github.com/conventional-changelog/standard-version) for commit guidelines.
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All notable changes to this project will be documented in this file. See [standard-version](https://github.com/conventional-changelog/standard-version) for commit guidelines.
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### [0.3.5](https://gitea.deepak.science:2222/physics/deepdog/compare/0.3.4...0.3.5) (2022-03-07)
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### Features
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* makes chunksize configurable ([88d9613](https://gitea.deepak.science:2222/physics/deepdog/commit/88d961313c1db0d49fd96939aa725a8706fa0412))
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### [0.3.4](https://gitea.deepak.science:2222/physics/deepdog/compare/0.3.3...0.3.4) (2022-03-06)
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### Features
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* Changes chunksize for multiprocessing ([0784cd5](https://gitea.deepak.science:2222/physics/deepdog/commit/0784cd53d79e00684506604f094b5d820b3994d4))
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### [0.3.3](https://gitea.deepak.science:2222/physics/deepdog/compare/0.3.2...0.3.3) (2022-03-06)
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### Bug Fixes
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* Fixes count to use cycles as well ([8617e4d](https://gitea.deepak.science:2222/physics/deepdog/commit/8617e4d2742b112cc824068150682ce3b2cdd879))
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### [0.3.2](https://gitea.deepak.science:2222/physics/deepdog/compare/0.3.1...0.3.2) (2022-03-06)
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### [0.3.2](https://gitea.deepak.science:2222/physics/deepdog/compare/0.3.1...0.3.2) (2022-03-06)
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@@ -10,8 +10,7 @@ import numpy
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# TODO: remove hardcode
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# TODO: remove hardcode
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COST_THRESHOLD = 1e-10
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CHUNKSIZE = 50
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# TODO: It's garbage to have this here duplicated from pdme.
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# TODO: It's garbage to have this here duplicated from pdme.
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DotInput = Tuple[numpy.typing.ArrayLike, float]
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DotInput = Tuple[numpy.typing.ArrayLike, float]
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@@ -44,7 +43,7 @@ class AltBayesRun():
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run_count: int
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run_count: int
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The number of runs to do.
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The number of runs to do.
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'''
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'''
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def __init__(self, dot_inputs: Sequence[DotInput], discretisations_with_names: Sequence[Tuple[str, pdme.model.Discretisation]], actual_model: pdme.model.Model, filename_slug: str, run_count: int, low_error: float = 0.9, high_error: float = 1.1, monte_carlo_count: int = 10000, monte_carlo_cycles: int = 10, max_frequency: float = 20, end_threshold: float = None) -> None:
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def __init__(self, dot_inputs: Sequence[DotInput], discretisations_with_names: Sequence[Tuple[str, pdme.model.Discretisation]], actual_model: pdme.model.Model, filename_slug: str, run_count: int, low_error: float = 0.9, high_error: float = 1.1, monte_carlo_count: int = 10000, monte_carlo_cycles: int = 10, max_frequency: float = 20, end_threshold: float = None, chunksize: int = CHUNKSIZE) -> None:
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self.dot_inputs = dot_inputs
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self.dot_inputs = dot_inputs
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self.dot_inputs_array = pdme.measurement.oscillating_dipole.dot_inputs_to_array(dot_inputs)
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self.dot_inputs_array = pdme.measurement.oscillating_dipole.dot_inputs_to_array(dot_inputs)
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self.discretisations = [disc for (_, disc) in discretisations_with_names]
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self.discretisations = [disc for (_, disc) in discretisations_with_names]
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@@ -58,6 +57,7 @@ class AltBayesRun():
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self.high_error = high_error
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self.high_error = high_error
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self.csv_fields = ["dipole_moment", "dipole_location", "dipole_frequency"]
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self.csv_fields = ["dipole_moment", "dipole_location", "dipole_frequency"]
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self.compensate_zeros = True
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self.compensate_zeros = True
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self.chunksize = chunksize
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for name in self.model_names:
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for name in self.model_names:
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self.csv_fields.extend([f"{name}_success", f"{name}_count", f"{name}_prob"])
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self.csv_fields.extend([f"{name}_success", f"{name}_count", f"{name}_prob"])
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@@ -98,7 +98,7 @@ class AltBayesRun():
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_logger.debug(f"Doing discretisation #{disc_count}")
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_logger.debug(f"Doing discretisation #{disc_count}")
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with multiprocessing.Pool(multiprocessing.cpu_count() - 1 or 1) as pool:
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with multiprocessing.Pool(multiprocessing.cpu_count() - 1 or 1) as pool:
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results.append(sum(
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results.append(sum(
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pool.imap_unordered(get_a_result, [(discretisation, self.dot_inputs_array, lows, highs, self.monte_carlo_count, self.max_frequency)] * self.monte_carlo_cycles)
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pool.imap_unordered(get_a_result, [(discretisation, self.dot_inputs_array, lows, highs, self.monte_carlo_count, self.max_frequency)] * self.monte_carlo_cycles, self.chunksize)
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))
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))
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_logger.debug("Done, constructing output now")
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_logger.debug("Done, constructing output now")
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@@ -112,9 +112,9 @@ class AltBayesRun():
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for model_index, (name, result) in enumerate(zip(self.model_names, results)):
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for model_index, (name, result) in enumerate(zip(self.model_names, results)):
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row[f"{name}_success"] = result
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row[f"{name}_success"] = result
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row[f"{name}_count"] = self.monte_carlo_count
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row[f"{name}_count"] = self.monte_carlo_count * self.monte_carlo_cycles
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successes.append(max(result, 0.5))
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successes.append(max(result, 0.5))
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counts.append(self.monte_carlo_count)
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counts.append(self.monte_carlo_count * self.monte_carlo_cycles)
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success_weight = sum([(succ / count) * prob for succ, count, prob in zip(successes, counts, self.probabilities)])
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success_weight = sum([(succ / count) * prob for succ, count, prob in zip(successes, counts, self.probabilities)])
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new_probabilities = [(succ / count) * old_prob / success_weight for succ, count, old_prob in zip(successes, counts, self.probabilities)]
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new_probabilities = [(succ / count) * old_prob / success_weight for succ, count, old_prob in zip(successes, counts, self.probabilities)]
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48
poetry.lock
generated
48
poetry.lock
generated
@@ -260,7 +260,7 @@ python-versions = "*"
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[[package]]
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[[package]]
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name = "mypy"
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name = "mypy"
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version = "0.931"
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version = "0.940"
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description = "Optional static typing for Python"
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description = "Optional static typing for Python"
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category = "dev"
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category = "dev"
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optional = false
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optional = false
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@@ -274,6 +274,7 @@ typing-extensions = ">=3.10"
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[package.extras]
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[package.extras]
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dmypy = ["psutil (>=4.0)"]
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dmypy = ["psutil (>=4.0)"]
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python2 = ["typed-ast (>=1.4.0,<2)"]
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python2 = ["typed-ast (>=1.4.0,<2)"]
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reports = ["lxml"]
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[[package]]
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[[package]]
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name = "mypy-extensions"
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name = "mypy-extensions"
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@@ -697,7 +698,7 @@ testing = ["pytest (>=6)", "pytest-checkdocs (>=2.4)", "pytest-flake8", "pytest-
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[metadata]
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[metadata]
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lock-version = "1.1"
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lock-version = "1.1"
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python-versions = "^3.8,<3.10"
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python-versions = "^3.8,<3.10"
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content-hash = "ba794e6f69d42e44e2b1abc40731fd78d2f417cdc9be12d6e752dbcfa95adaad"
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content-hash = "ac69ab9be2cde12f64be445f46af378b6943d3c19cbf9fd3e1b6b81371c7a5a6"
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[metadata.files]
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[metadata.files]
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atomicwrites = [
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atomicwrites = [
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@@ -898,26 +899,29 @@ mccabe = [
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{file = "mccabe-0.6.1.tar.gz", hash = "sha256:dd8d182285a0fe56bace7f45b5e7d1a6ebcbf524e8f3bd87eb0f125271b8831f"},
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{file = "mccabe-0.6.1.tar.gz", hash = "sha256:dd8d182285a0fe56bace7f45b5e7d1a6ebcbf524e8f3bd87eb0f125271b8831f"},
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]
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]
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mypy = [
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mypy = [
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{file = "mypy-0.931-cp310-cp310-macosx_10_9_x86_64.whl", hash = "sha256:3c5b42d0815e15518b1f0990cff7a705805961613e701db60387e6fb663fe78a"},
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{file = "mypy-0.940-cp310-cp310-macosx_10_9_universal2.whl", hash = "sha256:0fdc9191a49c77ab5fa0439915d405e80a1118b163ab03cd2a530f346b12566a"},
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{file = "mypy-0.931-cp310-cp310-macosx_11_0_arm64.whl", hash = "sha256:c89702cac5b302f0c5d33b172d2b55b5df2bede3344a2fbed99ff96bddb2cf00"},
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{file = "mypy-0.940-cp310-cp310-macosx_10_9_x86_64.whl", hash = "sha256:1903c92ff8642d521b4627e51a67e49f5be5aedb1fb03465b3aae4c3338ec491"},
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{file = "mypy-0.931-cp310-cp310-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:300717a07ad09525401a508ef5d105e6b56646f7942eb92715a1c8d610149714"},
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{file = "mypy-0.940-cp310-cp310-macosx_11_0_arm64.whl", hash = "sha256:471af97c35a32061883b0f8a3305ac17947fd42ce962ca9e2b0639eb9141492f"},
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||||||
{file = "mypy-0.931-cp310-cp310-win_amd64.whl", hash = "sha256:7b3f6f557ba4afc7f2ce6d3215d5db279bcf120b3cfd0add20a5d4f4abdae5bc"},
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{file = "mypy-0.940-cp310-cp310-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:13677cb8b050f03b5bb2e8bf7b2668cd918b001d56c2435082bbfc9d5f730f42"},
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||||||
{file = "mypy-0.931-cp36-cp36m-macosx_10_9_x86_64.whl", hash = "sha256:1bf752559797c897cdd2c65f7b60c2b6969ffe458417b8d947b8340cc9cec08d"},
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{file = "mypy-0.940-cp310-cp310-win_amd64.whl", hash = "sha256:2efd76893fb8327eca7e942e21b373e6f3c5c083ff860fb1e82ddd0462d662bd"},
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||||||
{file = "mypy-0.931-cp36-cp36m-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:4365c60266b95a3f216a3047f1d8e3f895da6c7402e9e1ddfab96393122cc58d"},
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{file = "mypy-0.940-cp36-cp36m-macosx_10_9_x86_64.whl", hash = "sha256:f8fe1bfab792e4300f80013edaf9949b34e4c056a7b2531b5ef3a0fb9d598ae2"},
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||||||
{file = "mypy-0.931-cp36-cp36m-win_amd64.whl", hash = "sha256:1b65714dc296a7991000b6ee59a35b3f550e0073411ac9d3202f6516621ba66c"},
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{file = "mypy-0.940-cp36-cp36m-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:2dba92f58610d116f68ec1221fb2de2a346d081d17b24a784624389b17a4b3f9"},
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{file = "mypy-0.931-cp37-cp37m-macosx_10_9_x86_64.whl", hash = "sha256:e839191b8da5b4e5d805f940537efcaa13ea5dd98418f06dc585d2891d228cf0"},
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{file = "mypy-0.940-cp36-cp36m-win_amd64.whl", hash = "sha256:712affcc456de637e774448c73e21c84dfa5a70bcda34e9b0be4fb898a9e8e07"},
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{file = "mypy-0.931-cp37-cp37m-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:50c7346a46dc76a4ed88f3277d4959de8a2bd0a0fa47fa87a4cde36fe247ac05"},
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{file = "mypy-0.940-cp37-cp37m-macosx_10_9_x86_64.whl", hash = "sha256:8aaf18d0f8bc3ffba56d32a85971dfbd371a5be5036da41ac16aefec440eff17"},
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||||||
{file = "mypy-0.931-cp37-cp37m-win_amd64.whl", hash = "sha256:d8f1ff62f7a879c9fe5917b3f9eb93a79b78aad47b533911b853a757223f72e7"},
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{file = "mypy-0.940-cp37-cp37m-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:51be997c1922e2b7be514a5215d1e1799a40832c0a0dee325ba8794f2c48818f"},
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||||||
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{file = "mypy-0.940-cp37-cp37m-win_amd64.whl", hash = "sha256:628f5513268ebbc563750af672ccba5eef7f92d2d90154233edd498dfb98ca4e"},
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||||||
{file = "mypy-0.931-cp38-cp38-macosx_11_0_arm64.whl", hash = "sha256:1b06268df7eb53a8feea99cbfff77a6e2b205e70bf31743e786678ef87ee8069"},
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||||||
{file = "mypy-0.931-cp38-cp38-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:8c11003aaeaf7cc2d0f1bc101c1cc9454ec4cc9cb825aef3cafff8a5fdf4c799"},
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{file = "mypy-0.940-cp38-cp38-macosx_10_9_x86_64.whl", hash = "sha256:b2fa5f2d597478ccfe1f274f8da2f50ea1e63da5a7ae2342c5b3b2f3e57ec340"},
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{file = "mypy-0.931-cp38-cp38-win_amd64.whl", hash = "sha256:d9d2b84b2007cea426e327d2483238f040c49405a6bf4074f605f0156c91a47a"},
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{file = "mypy-0.940-cp38-cp38-macosx_11_0_arm64.whl", hash = "sha256:b1a116c451b41e35afc09618f454b5c2704ba7a4e36f9ff65014fef26bb6075b"},
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||||||
{file = "mypy-0.931-cp39-cp39-macosx_10_9_x86_64.whl", hash = "sha256:ff3bf387c14c805ab1388185dd22d6b210824e164d4bb324b195ff34e322d166"},
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{file = "mypy-0.940-cp38-cp38-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:1f66f2309cdbb07e95e60e83fb4a8272095bd4ea6ee58bf9a70d5fb304ec3e3f"},
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||||||
{file = "mypy-0.931-cp39-cp39-macosx_11_0_arm64.whl", hash = "sha256:5b56154f8c09427bae082b32275a21f500b24d93c88d69a5e82f3978018a0266"},
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{file = "mypy-0.940-cp38-cp38-win_amd64.whl", hash = "sha256:3ac14949677ae9cb1adc498c423b194ad4d25b13322f6fe889fb72b664c79121"},
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||||||
{file = "mypy-0.931-cp39-cp39-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:8ca7f8c4b1584d63c9a0f827c37ba7a47226c19a23a753d52e5b5eddb201afcd"},
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{file = "mypy-0.940-cp39-cp39-macosx_10_9_universal2.whl", hash = "sha256:6eab2bcc2b9489b7df87d7c20743b66d13254ad4d6430e1dfe1a655d51f0933d"},
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||||||
{file = "mypy-0.931-cp39-cp39-win_amd64.whl", hash = "sha256:74f7eccbfd436abe9c352ad9fb65872cc0f1f0a868e9d9c44db0893440f0c697"},
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{file = "mypy-0.940-cp39-cp39-macosx_10_9_x86_64.whl", hash = "sha256:0b52778a018559a256c819ee31b2e21e10b31ddca8705624317253d6d08dbc35"},
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||||||
{file = "mypy-0.931-py3-none-any.whl", hash = "sha256:1171f2e0859cfff2d366da2c7092b06130f232c636a3f7301e3feb8b41f6377d"},
|
{file = "mypy-0.940-cp39-cp39-macosx_11_0_arm64.whl", hash = "sha256:d9d7647505bf427bc7931e8baf6cacf9be97e78a397724511f20ddec2a850752"},
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||||||
{file = "mypy-0.931.tar.gz", hash = "sha256:0038b21890867793581e4cb0d810829f5fd4441aa75796b53033af3aa30430ce"},
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{file = "mypy-0.940-cp39-cp39-manylinux_2_5_x86_64.manylinux1_x86_64.manylinux_2_12_x86_64.manylinux2010_x86_64.whl", hash = "sha256:a0e5657ccaedeb5fdfda59918cc98fc6d8a8e83041bc0cec347a2ab6915f9998"},
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||||||
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{file = "mypy-0.940-cp39-cp39-win_amd64.whl", hash = "sha256:83f66190e3c32603217105913fbfe0a3ef154ab6bbc7ef2c989f5b2957b55840"},
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||||||
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{file = "mypy-0.940-py3-none-any.whl", hash = "sha256:a168da06eccf51875fdff5f305a47f021f23f300e2b89768abdac24538b1f8ec"},
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||||||
|
{file = "mypy-0.940.tar.gz", hash = "sha256:71bec3d2782d0b1fecef7b1c436253544d81c1c0e9ca58190aed9befd8f081c5"},
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||||||
]
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]
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||||||
mypy-extensions = [
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mypy-extensions = [
|
||||||
{file = "mypy_extensions-0.4.3-py2.py3-none-any.whl", hash = "sha256:090fedd75945a69ae91ce1303b5824f428daf5a028d2f6ab8a299250a846f15d"},
|
{file = "mypy_extensions-0.4.3-py2.py3-none-any.whl", hash = "sha256:090fedd75945a69ae91ce1303b5824f428daf5a028d2f6ab8a299250a846f15d"},
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||||||
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@@ -1,6 +1,6 @@
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|||||||
[tool.poetry]
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[tool.poetry]
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||||||
name = "deepdog"
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name = "deepdog"
|
||||||
version = "0.3.2"
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version = "0.3.5"
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||||||
description = ""
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description = ""
|
||||||
authors = ["Deepak Mallubhotla <dmallubhotla+github@gmail.com>"]
|
authors = ["Deepak Mallubhotla <dmallubhotla+github@gmail.com>"]
|
||||||
|
|
||||||
@@ -12,7 +12,7 @@ pdme = "^0.5.4"
|
|||||||
pytest = ">=6"
|
pytest = ">=6"
|
||||||
flake8 = "^4.0.1"
|
flake8 = "^4.0.1"
|
||||||
pytest-cov = "^3.0.0"
|
pytest-cov = "^3.0.0"
|
||||||
mypy = "^0.931"
|
mypy = "^0.940"
|
||||||
python-semantic-release = "^7.24.0"
|
python-semantic-release = "^7.24.0"
|
||||||
|
|
||||||
[build-system]
|
[build-system]
|
||||||
|
Reference in New Issue
Block a user