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rbharath
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Apr 1, 2026
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| """Batch and single-molecule retrosynthesis runners. | |||
rbharath
reviewed
Apr 1, 2026
| smiles: str, | ||
| *, | ||
| llm: str = "anthropic/claude-3-7-sonnet-20250219:adv", | ||
| az_model: str = "Pistachio_100+", |
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Separate PR we need aizynthfinder
rbharath
reviewed
Apr 1, 2026
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| Returns | ||
| ------- | ||
| dict[str, Any] |
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More details on output format please
rbharath
reviewed
Apr 1, 2026
| from src.utils.job_context import logger as context_logger | ||
| from src.utils.parse import format_output | ||
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| def _run(smiles, **kwargs): |
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Make it a public function; avoid "private" functions
rbharath
reviewed
Apr 1, 2026
| ) | ||
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| stability_flag = str(stability_check) | ||
| semaphore = asyncio.Semaphore(max_concurrent) |
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You need to document this thoroughly
rbharath
reviewed
Apr 1, 2026
| hallucination_mode, hallucination_classifier, | ||
| ) | ||
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| stability_flag = str(stability_check) |
rbharath
reviewed
Apr 1, 2026
| semaphore = asyncio.Semaphore(max_concurrent) | ||
| loop = asyncio.get_running_loop() | ||
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| async def _process(smi: str) -> dict[str, Any]: |
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Description
Fix #(issue)
we still need
cache.py
parse.py
rec_prithvi.py
prithvi.py
llm.py
from src/
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