rowan-python 2.1.9__py3-none-any.whl → 2.1.10__py3-none-any.whl
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- rowan/folder.py +29 -13
- rowan/workflow.py +27 -0
- {rowan_python-2.1.9.dist-info → rowan_python-2.1.10.dist-info}/METADATA +2 -2
- {rowan_python-2.1.9.dist-info → rowan_python-2.1.10.dist-info}/RECORD +6 -6
- {rowan_python-2.1.9.dist-info → rowan_python-2.1.10.dist-info}/WHEEL +0 -0
- {rowan_python-2.1.9.dist-info → rowan_python-2.1.10.dist-info}/licenses/LICENSE +0 -0
rowan/folder.py
CHANGED
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@@ -58,6 +58,7 @@ class Folder(BaseModel):
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return self
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+
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def update(
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self,
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name: str | None = None,
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@@ -110,6 +111,15 @@ class Folder(BaseModel):
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response = client.delete(f"/folder/{self.uuid}")
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response.raise_for_status()
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def print_folder_tree(self, max_depth: int = 10, show_uuids: bool = False) -> None:
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115
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"""
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116
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Retrieves a folder tree from the API.
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117
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:param max_depth: The maximum depth of the folder tree.
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119
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:param show_uuids: Whether to show the UUIDs of the folders.
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120
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:raises HTTPError: If the API request fails.
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"""
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print_folder_tree(self.uuid, max_depth, show_uuids)
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def retrieve_folder(uuid: str) -> Folder:
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"""
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@@ -125,19 +135,6 @@ def retrieve_folder(uuid: str) -> Folder:
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return Folder(**response.json())
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128
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-
def home_folder() -> Folder:
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"""
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-
Retrieves the home folder from the API.
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-
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:return: A Folder object representing the home folder.
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:raises HTTPError: If the API request fails.
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"""
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with api_client() as client:
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response = client.get("/user/me/root_folders")
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response.raise_for_status()
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return Folder(**response.json()["user_root"])
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-
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-
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def list_folders(
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parent_uuid: str | None = None,
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name_contains: str | None = None,
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@@ -210,3 +207,22 @@ def create_folder(
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response.raise_for_status()
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folder_data = response.json()
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return Folder(**folder_data)
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+
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def print_folder_tree(uuid: str, max_depth: int = 10, show_uuids: bool = False) -> None:
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"""
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Retrieves a folder tree from the API.
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:param uuid: The UUID of the root of the folder tree.
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:param max_depth: The maximum depth of the folder tree.
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:param show_uuids: Whether to show the UUIDs of the folders.
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:raises HTTPError: If the API request fails.
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"""
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params: dict[str, Any] = {
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"max_depth": max_depth,
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"show_uuids": show_uuids,
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}
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with api_client() as client:
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response = client.get(f"/folder/{uuid}/folder_tree", params=params)
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response.raise_for_status()
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folder_data = response.json()
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print(folder_data)
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rowan/workflow.py
CHANGED
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@@ -408,6 +408,33 @@ def retrieve_workflow(uuid: str) -> Workflow:
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return Workflow(**response.json())
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def retrieve_workflows(uuids: list[str]) -> list[Workflow]:
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"""
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Retrieves a list of workflows from the API.
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:param uuids: The UUIDs of the workflows to retrieve.
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:return: A list of Workflow objects representing the retrieved workflows.
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:raises HTTPError: If the API request fails.
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"""
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with api_client() as client:
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response = client.post("/workflow/batch_retrieve", json={"uuids": uuids})
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response.raise_for_status()
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return [Workflow(**workflow_data) for workflow_data in response.json()]
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def batch_poll_status(uuids: list[str]) -> list[Workflow]:
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"""
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Polls the status of a list of workflows.
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:param uuids: The UUIDs of the workflows to poll.
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:return: A dictionary of statuses and the count of workflows in that status.
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:raises HTTPError: If the API request fails.
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"""
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with api_client() as client:
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response = client.post("/workflow/batch_status", json={"uuids": uuids})
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response.raise_for_status()
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return response.json()
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+
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+
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def retrieve_calculation_molecules(
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uuid: str, return_frequencies: bool = False
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) -> list[dict[str, Any]]:
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@@ -1,6 +1,6 @@
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Metadata-Version: 2.4
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Name: rowan-python
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Version: 2.1.
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Version: 2.1.10
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Summary: Rowan Python Library
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Project-URL: Homepage, https://github.com/rowansci/rowan-client
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Project-URL: Bug Tracker, https://github.com/rowansci/rowan-client/issues
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@@ -11,7 +11,7 @@ Requires-Dist: httpx
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Requires-Dist: nest-asyncio
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Requires-Dist: rdkit
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Requires-Dist: setuptools
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Requires-Dist: stjames>=0.0.
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Requires-Dist: stjames>=0.0.128
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Description-Content-Type: text/markdown
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# Rowan Python Library
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@@ -1,15 +1,15 @@
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rowan/__init__.py,sha256=2rz6dW0l9DzawiFi6S0WSv8XlZq1CoTBKJrsJ1uesvk,171
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rowan/constants.py,sha256=emCH4m9OL2Hm5E-6mJGM_FgzrK_JrZT-FiKJ6pMNQ4Y,84
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rowan/folder.py,sha256=
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rowan/folder.py,sha256=MF3SU7uG6Hl2SJLFxbPmbhosS-pPEHwbTyummaaRdzM,7509
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rowan/project.py,sha256=ALPPkMa_cg7w5OkXno1cs6acCofw8AOUYRSeWgr3L0o,3774
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rowan/protein.py,sha256=mFSVCr-08bSikXBUtJtSWzjKcVAuBmTeRckn7JUHYSE,8810
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rowan/py.typed,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
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rowan/user.py,sha256=Dl--NPUPATKCs2VmILsW8HnLiunG0Lxr0n6mKuHm21U,3891
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rowan/utils.py,sha256=64II-cPOe_SFJK302Bm8hP62d_3_CgnTVYCbn3zKT7U,3334
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rowan/workflow.py,sha256=
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rowan/workflow.py,sha256=l21KygojLRsM6JI2b0H-hcbOnaFsDZGhbqmLy3sexjA,61360
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rowan/rowan_rdkit/__init__.py,sha256=EATX2VRzywzKxqkpCUMTf7RNQLkWsfi5VcCNDW6EIiw,503
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rowan/rowan_rdkit/chem_utils.py,sha256=sKCzul2e0ldVYTBImhTwso7ddNgPKmvS-OmvCEjVJH0,34788
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rowan_python-2.1.
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rowan_python-2.1.
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rowan_python-2.1.
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rowan_python-2.1.
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rowan_python-2.1.10.dist-info/METADATA,sha256=8AzU2Im1apsPTrfFyZ3OYfPYaI9V_vwmRjKOfOy6xiI,1601
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rowan_python-2.1.10.dist-info/WHEEL,sha256=qtCwoSJWgHk21S1Kb4ihdzI2rlJ1ZKaIurTj_ngOhyQ,87
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rowan_python-2.1.10.dist-info/licenses/LICENSE,sha256=i05z7xEhyrg6f8j0lR3XYjShnF-MJGFQ-DnpsZ8yiVI,1084
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rowan_python-2.1.10.dist-info/RECORD,,
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File without changes
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File without changes
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