"""Spec-RAG: Cross-modal retrieval and generation utilities.""" from importlib import import_module _EXPORTS = { "SMILESEmbedder": ("embeddings", "SMILESEmbedder"), "SpectrumEmbedder": ("embeddings", "SpectrumEmbedder"), "MolT5WithEmbeddings": ("molt5_with_embeddings", "MolT5WithEmbeddings"), "build_hnsw_index": ("faiss_index", "build_hnsw_index"), "save_index": ("faiss_index", "save_index"), "load_index": ("faiss_index", "load_index"), "search_index": ("retrieval", "search_index"), "format_molt5_prompt": ("prompt", "format_molt5_prompt"), "format_chat_example": ("prompt", "format_chat_example"), "SpecAgent": ("spec_agent", "SpecAgent"), "validate_smiles": ("agent_tools", "validate_smiles"), "calculate_mass_error": ("agent_tools", "calculate_mass_error"), "PerceiverResampler": ("perceiver_resampler", "PerceiverResampler"), "SpectraReasonEncoder": ("spectra_reason_encoder", "SpectraReasonEncoder"), "build_spectra_reason_encoder": ("spectra_reason_encoder", "build_spectra_reason_encoder"), "get_smiles_constraint": ("gcd_inference", "get_smiles_constraint"), "predict_smiles_from_spectrum": ("gcd_inference", "predict_smiles_from_spectrum"), } __all__ = list(_EXPORTS) def __getattr__(name): if name not in _EXPORTS: raise AttributeError(f"module {__name__!r} has no attribute {name!r}") module_name, attr_name = _EXPORTS[name] module = import_module(f".{module_name}", __name__) value = getattr(module, attr_name) globals()[name] = value return value def __dir__(): return sorted(list(globals().keys()) + __all__)