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500 Internal Server Error
ERROR: Exception in ASGI application
Traceback (most recent call last):
File "/opt/conda/lib/python3.10/site-packages/uvicorn/protocols/http/httptools_impl.py", line 435, in run_asgi
result = await app( # type: ignore[func-returns-value]
File "/opt/conda/lib/python3.10/site-packages/uvicorn/middleware/proxy_headers.py", line 78, in __call__
return await self.app(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/fastapi/applications.py", line 284, in __call__
await super().__call__(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/applications.py", line 122, in __call__
await self.middleware_stack(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/errors.py", line 184, in __call__
raise exc
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/errors.py", line 162, in __call__
await self.app(scope, receive, _send)
File "/opt/conda/lib/python3.10/site-packages/prometheus_fastapi_instrumentator/middleware.py", line 169, in __call__
raise exc
File "/opt/conda/lib/python3.10/site-packages/prometheus_fastapi_instrumentator/middleware.py", line 167, in __call__
await self.app(scope, receive, send_wrapper)
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/exceptions.py", line 79, in __call__
raise exc
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/exceptions.py", line 68, in __call__
await self.app(scope, receive, sender)
File "/opt/conda/lib/python3.10/site-packages/fastapi/middleware/asyncexitstack.py", line 20, in __call__
raise e
File "/opt/conda/lib/python3.10/site-packages/fastapi/middleware/asyncexitstack.py", line 17, in __call__
await self.app(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/routing.py", line 718, in __call__
await route.handle(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/routing.py", line 443, in handle
await self.app(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/fastapi/applications.py", line 284, in __call__
await super().__call__(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/applications.py", line 122, in __call__
await self.middleware_stack(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/errors.py", line 184, in __call__
raise exc
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/errors.py", line 162, in __call__
await self.app(scope, receive, _send)
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/exceptions.py", line 79, in __call__
raise exc
File "/opt/conda/lib/python3.10/site-packages/starlette/middleware/exceptions.py", line 68, in __call__
await self.app(scope, receive, sender)
File "/opt/conda/lib/python3.10/site-packages/fastapi/middleware/asyncexitstack.py", line 20, in __call__
raise e
File "/opt/conda/lib/python3.10/site-packages/fastapi/middleware/asyncexitstack.py", line 17, in __call__
await self.app(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/routing.py", line 718, in __call__
await route.handle(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/routing.py", line 276, in handle
await self.app(scope, receive, send)
File "/opt/conda/lib/python3.10/site-packages/starlette/routing.py", line 66, in app
response = await func(request)
File "/opt/conda/lib/python3.10/site-packages/fastapi/routing.py", line 241, in app
raw_response = await run_endpoint_function(
File "/opt/conda/lib/python3.10/site-packages/fastapi/routing.py", line 167, in run_endpoint_function
return await dependant.call(**values)
File "/code/app/routers/converters.py", line 78, in Create3D_Coordinates
content=get3Dconformers(smiles, depict=False),
File "/code/app/modules/toolkits/rdkit_wrapper.py", line 108, in get3Dconformers
AllChem.MMFFOptimizeMolecule(mol, maxIters=200)
ValueError: Bad Conformer Id
The text was updated successfully, but these errors were encountered:
https://dev.api.naturalproducts.net/latest/convert/mol3D?smiles=CC%28%3DCCC%2FC%28%3DC%2FCC%2FC%28%3DC%2FCC%2FC%28%3DC%2FCCC%28C%29CCOP%28%3DO%29%28O%29OP%28%3DO%29%28O%29O%5BC%40%40H%5D1%5BC%40%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O1%29O%5BC%40H%5D2%5BC%40%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O2%29O%5BC%40H%5D3%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%5BC%40%40H%5D4%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%5BC%40%40H%5D5%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O5%29O%5BC%40%40H%5D6%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O6%29O%29O%29O%29O%29O%29O4%29O%29O%5BC%40%40H%5D7%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O7%29O%5BC%40%40H%5D8%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O8%29O%29O%29O%29O%29O%29O%29O3%29O%29O%5BC%40%40H%5D9%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O9%29O%29O%29O%5BC%40%40H%5D%2510%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O%2510%29O%29O%29O%5BC%40%40H%5D%2511%5BC%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O%2511%29O%29O%5BC%40%40H%5D%2512%5BC%40%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O%2512%29O%29O%5BC%40%40H%5D%2513%5BC%40%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O%2513%29O%29O%29O%5BC%40%40H%5D%2514%5BC%40%40H%5D%28%5BC%40H%5D%28%5BC%40%40H%5D%28%5BC%40%40H%5D%28CO%29O%2514%29O%29O%29O%29O%29O%29O%29O%29NC%28%3DO%29C%29O%29NC%28%3DO%29C%29%2FC%29%2FC%29%2FC%29C&generator=rdkit
Log -
The text was updated successfully, but these errors were encountered: