first add

__init__.py

@@ -0,0 +1,30 @@
+"""
+并行广谱抗菌预测模块
+
+提供高性能的分子广谱抗菌活性预测功能。
+"""
+
+from .broad_spectrum_api import (
+    ParallelBroadSpectrumPredictor,
+    BroadSpectrumPredictor,
+    PredictionConfig,
+    MoleculeInput,
+    BroadSpectrumResult,
+    create_predictor,
+    predict_smiles,
+    predict_file
+)
+
+__version__ = "1.0.0"
+__author__ = "Your Name"
+
+__all__ = [
+    "ParallelBroadSpectrumPredictor",
+    "BroadSpectrumPredictor", 
+    "PredictionConfig",
+    "MoleculeInput",
+    "BroadSpectrumResult",
+    "create_predictor",
+    "predict_smiles",
+    "predict_file"
+]