533 lines
20 KiB
Python
Executable File
533 lines
20 KiB
Python
Executable File
#!/usr/bin/env python3
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"""
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Recompute per-fold ROC plots for a completed multifold run using the saved
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best checkpoints instead of the final epoch.
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Example:
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python scripts/rebuild_run_best_plots.py \
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--run-dir analysis_data/1029_Baseline_Balanced_Resnet/1029_Baseline_Balanced_Resnet_20251029_163906 \
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--head image
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"""
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import argparse
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import logging
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import json
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from pathlib import Path
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from types import SimpleNamespace
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import matplotlib
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import sys
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REPO_ROOT = Path(__file__).resolve().parents[3]
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if str(REPO_ROOT) not in sys.path:
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sys.path.insert(0, str(REPO_ROOT))
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matplotlib.use("Agg")
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import matplotlib.pyplot as plt # noqa: E402
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import numpy as np # noqa: E402
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import pandas as pd # noqa: E402
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import torch # noqa: E402
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from sklearn.metrics import auc, roc_auc_score, roc_curve # noqa: E402
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from classes import build_papila_clinical # noqa: E402
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from classes.hypertower import HyperTower # noqa: E402
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try: # Allow checkpoints that stored pandas DataFrames in their args.
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from torch.serialization import add_safe_globals # type: ignore
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add_safe_globals([pd.DataFrame])
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except (ImportError, AttributeError):
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pass
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def parse_args() -> argparse.Namespace:
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ap = argparse.ArgumentParser(description="Rebuild ROC plots for an existing multifold run.")
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ap.add_argument("--run-dir", required=True, type=Path, help="Path to the run directory under analysis_data.")
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ap.add_argument("--head", default="image", choices=["image", "fused", "metadata"], help="Which prediction head to plot.")
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ap.add_argument("--class-names", nargs="*", default=None, help="Optional class names to control plot labels.")
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ap.add_argument("--overwrite", action="store_true", help="Overwrite existing .npy probability dumps if present.")
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ap.add_argument(
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"--use-holdout",
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action="store_true",
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help="Evaluate checkpoints on the saved holdout set instead of the fold validation splits.",
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)
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return ap.parse_args()
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def load_cli_args(run_dir: Path) -> dict:
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cli_path = run_dir / "cli_args.json"
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if not cli_path.exists():
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raise FileNotFoundError(f"Missing cli_args.json in {run_dir}")
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with cli_path.open("r", encoding="utf-8") as fh:
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return json.load(fh)
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def load_summary(run_dir: Path) -> dict:
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summary_path = run_dir / "summary.json"
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if not summary_path.exists():
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raise FileNotFoundError(f"Missing summary.json in {run_dir}")
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with summary_path.open("r", encoding="utf-8") as fh:
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return json.load(fh)
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def resolve_data_dir(raw_dir: str) -> str:
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"""
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Resolve dataset paths saved in legacy cli_args.json.
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Older runs often store "ClinicalData"/"FundusImages" relative to a
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dataset root, while current repo layout uses "Papila/<dir>".
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"""
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p = Path(raw_dir)
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if p.exists():
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return str(p)
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candidates = [
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REPO_ROOT / p,
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REPO_ROOT / "Papila" / p,
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]
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for cand in candidates:
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if cand.exists():
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return str(cand)
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return str(p)
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def prepare_clinical(cli_args: dict, run_dir: Path) -> tuple:
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image_dir = resolve_data_dir(cli_args["image_dir"])
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clinical_dir = resolve_data_dir(cli_args["clinical_dir"])
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clinical = build_papila_clinical(
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image_dir,
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clinical_dir,
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cli_args["label_col"],
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cli_args["cat_cols"],
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n_splits=cli_args["n_splits"],
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random_seed=cli_args["fold_seed"],
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)
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holdout_path = run_dir / "holdout.csv"
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holdout_df = pd.read_csv(holdout_path) if holdout_path.exists() else None
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if holdout_df is not None:
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if cli_args["eval_mode"] == "binary":
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holdout_df = holdout_df[holdout_df[cli_args["label_col"]].isin([0, 1])].reset_index(drop=True)
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join_cols = [c for c in holdout_df.columns if c in clinical.df.columns]
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if not join_cols:
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raise RuntimeError("Holdout CSV found but no overlapping columns with clinical dataframe.")
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marker = holdout_df.assign(_holdout_marker=1)
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merged = clinical.df.merge(marker, on=join_cols, how="left")
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train_df = merged[merged["_holdout_marker"].isna()].drop(columns=["_holdout_marker"]).reset_index(drop=True)
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clinical.frames = [train_df.copy()]
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clinical.df = train_df.copy()
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clinical._infer_or_validate_feature_types()
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clinical._compute_numeric_stats()
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clinical._build_cat_maps()
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clinical._compute_feature_dim()
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clinical._build_kfold_indices()
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return clinical, holdout_df
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def build_ht_args(cli_args: dict, fold: int, run_dir: Path, models_dir: Path, holdout_df):
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image_dir = resolve_data_dir(cli_args["image_dir"])
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clinical_dir = resolve_data_dir(cli_args["clinical_dir"])
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# Copy of the training-time namespace so HyperTower can be re-instantiated.
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return SimpleNamespace(
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image_dir=image_dir,
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clinical_dir=clinical_dir,
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label_col=cli_args["label_col"],
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cat_cols=cli_args["cat_cols"],
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batch_size=cli_args["batch_size"],
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epochs=cli_args["epochs"],
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lr=cli_args["lr"],
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num_classes=cli_args["num_classes"],
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img_augment=cli_args.get("img_augment", True),
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focal_gamma=cli_args.get("focal_gamma", 0.0),
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eval_mode=cli_args["eval_mode"],
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fold=fold,
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run_dir=str(run_dir),
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models_dir=str(models_dir),
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backbone=cli_args["backbone"],
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freeze_ratio=cli_args["freeze_ratio"],
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fusion_mode=cli_args["fusion_mode"],
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use_se=cli_args.get("use_se", True),
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se_reduction=cli_args.get("se_reduction", 16),
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se_pre_norm=cli_args.get("se_pre_norm", True),
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se_where=cli_args.get("se_where", "bridge"),
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se_reduction_tower=cli_args.get("se_reduction_tower", cli_args.get("se_reduction", 16)),
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se_pre_norm_tower=cli_args.get("se_pre_norm_tower", cli_args.get("se_pre_norm", True)),
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warmup_tower_epochs=cli_args.get("warmup_tower_epochs", 0),
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warmup_fused_epochs=cli_args.get("warmup_fused_epochs", 0),
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gradual_thaw=cli_args.get("gradual_thaw", False),
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thaw_phase_duration=cli_args.get("thaw_phase_duration", 5),
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thaw_ratio=cli_args.get("thaw_ratio", 0.33),
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thaw_target=cli_args.get("thaw_target", "image"),
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thaw_start_epoch=cli_args.get("thaw_start_epoch", -1),
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initial_freeze=cli_args.get("initial_freeze", False),
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bcd_prob=0.5,
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bcd_p0=0.20,
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bcd_min=0.05,
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bcd_max=0.30,
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bcd_k=0.4,
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bcd_metric="auc",
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bcd_alpha_batch=0.2,
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bcd_alpha_tower=0.3,
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bcd_explore_floor=0.15,
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aux_img=0.05,
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aux_md=0.05,
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aux_detach=True,
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ema_alpha=0.9,
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entropy_ema=0.7,
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early_stop=cli_args.get("early_stop", False),
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early_metric=cli_args.get("early_metric"),
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early_mode=cli_args.get("early_mode", "auto"),
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early_patience=cli_args.get("early_patience", 7),
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early_min_delta=cli_args.get("early_min_delta", 0.0),
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checkpoint_best=cli_args.get("checkpoint_best", False),
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holdout_df=holdout_df,
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img_crop_manifest=cli_args.get("img_crop_manifest"),
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img_crop_weights=cli_args.get("img_crop_weights"),
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img_crop_normalize=cli_args.get("img_crop_normalize"),
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img_crop_threshold=cli_args.get("img_crop_threshold"),
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img_crop_scale=cli_args.get("img_crop_scale", 2.5),
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img_crop_size=cli_args.get("img_crop_size", 224),
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img_crop_cache=cli_args.get("img_crop_cache"),
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img_crop_tta=cli_args.get("img_crop_tta", False),
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img_crop_gt=cli_args.get("img_crop_gt", False),
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img_geometry_features=cli_args.get("img_geometry_features", False),
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balanced_sampler=cli_args.get("balanced_sampler", False),
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)
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def collect_logits(ht, loader):
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"""Mirror Multifold.eval_collect_logits but for a provided loader."""
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device = ht.device
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ht.img_tower.eval()
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ht.md_tower.eval()
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outputs = []
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with torch.no_grad():
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if ht.mode == "vote":
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ht.head_img.eval()
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ht.head_md.eval()
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ht.vote.eval()
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else:
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ht.bridge.eval()
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for batch in loader:
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if len(batch) == 4:
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imgs, metas, geometry, labels = batch
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else:
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imgs, metas, labels = batch
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geometry = None
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imgs = imgs.to(device)
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metas = metas.to(device)
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labels = labels.to(device)
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if geometry is not None and geometry.numel() > 0:
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geometry = geometry.to(device)
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else:
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geometry = None
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if ht.mode == "vote":
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img_feats = ht.img_tower(imgs, geometry)
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md_feats = ht.md_tower(metas)
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out_img = ht.head_img(img_feats)
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out_md = ht.head_md(md_feats)
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out_fused = ht.vote(out_img, out_md)
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else:
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img_feats = ht.img_tower(imgs, geometry)
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md_feats = ht.md_tower(metas)
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result = ht.bridge(img_feats, md_feats)
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if isinstance(result, tuple):
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out_fused, out_img, out_md = result
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else:
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out_fused, out_img, out_md = result, None, None
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outputs.append(
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(
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labels.detach().cpu().numpy(),
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torch.softmax(out_fused, dim=1).detach().cpu().numpy() if out_fused is not None else None,
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torch.softmax(out_img, dim=1).detach().cpu().numpy() if out_img is not None else None,
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torch.softmax(out_md, dim=1).detach().cpu().numpy() if out_md is not None else None,
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)
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)
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if not outputs:
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return np.array([]), None, None, None
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y_all, pf, pi, pm = zip(*outputs)
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y_true = np.concatenate(y_all, axis=0)
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probs_f = np.concatenate([p for p in pf if p is not None], axis=0) if any(p is not None for p in pf) else None
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probs_i = np.concatenate([p for p in pi if p is not None], axis=0) if any(p is not None for p in pi) else None
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probs_m = np.concatenate([p for p in pm if p is not None], axis=0) if any(p is not None for p in pm) else None
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return y_true, probs_f, probs_i, probs_m
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def compute_per_class_curves(y_true, probs):
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if probs is None:
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return {}
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num_classes = probs.shape[1]
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curves = {}
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for k in range(num_classes):
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y_bin = (y_true == k).astype(np.uint8)
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fpr, tpr, _ = roc_curve(y_bin, probs[:, k])
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curves[k] = {"fpr": fpr, "tpr": tpr, "auc": auc(fpr, tpr) if len(fpr) > 1 else np.nan}
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return curves
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def choose_head_probs(head: str, probs_f, probs_i, probs_m):
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if head == "fused":
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return probs_f
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if head == "metadata":
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return probs_m
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return probs_i
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def legacy_probs_suffix(head: str) -> str:
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if head == "image":
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return "img"
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if head == "metadata":
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return "md"
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return "fused"
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def ensure_binary_slice(y_true, *arrays):
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mask = np.isin(y_true, [0, 1])
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filtered = [y_true[mask]]
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for arr in arrays:
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if arr is None:
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filtered.append(None)
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else:
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filtered.append(arr[mask])
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return filtered
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def plot_overlays(
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per_fold_curves,
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out_dir: Path,
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class_names: list[str],
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head: str,
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eval_mode: str,
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suffix: str = "",
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):
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keys = sorted({k for _, curves in per_fold_curves for k in curves.keys()})
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if eval_mode == "binary":
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keys = [k for k in keys if k == 1]
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if not keys:
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return
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name_map = {k: (class_names[k] if k < len(class_names) else f"class_{k}") for k in keys}
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out_dir.mkdir(parents=True, exist_ok=True)
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for k in keys:
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fig = plt.figure(figsize=(10, 8))
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ax = fig.add_subplot(111)
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ax.plot([0, 1], [0, 1], linestyle="--", linewidth=1, color="grey")
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for fold_idx, curves in per_fold_curves:
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if k not in curves:
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continue
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fpr = curves[k]["fpr"]
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tpr = curves[k]["tpr"]
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auc_val = curves[k]["auc"]
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label = f"Fold {fold_idx} (AUC {auc_val:.3f})" if auc_val == auc_val else f"Fold {fold_idx}"
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ax.plot(fpr, tpr, linewidth=1.5, label=label)
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ax.set_xlabel("False Positive Rate")
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ax.set_ylabel("True Positive Rate")
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ax.set_title(f"{head} head — {name_map[k]} ROC per fold")
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ax.legend(loc="lower right")
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fig.tight_layout()
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safe_name = name_map[k].replace(" ", "_")
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suffix_str = suffix if suffix else ""
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fig.savefig(out_dir / f"roc_{head}_{safe_name}_perfold{suffix_str}.png", dpi=160)
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plt.close(fig)
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def plot_mean_sd(
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per_fold_curves,
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out_dir: Path,
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class_names: list[str],
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head: str,
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eval_mode: str,
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suffix: str = "",
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):
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keys = sorted({k for _, curves in per_fold_curves for k in curves.keys()})
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if eval_mode == "binary":
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keys = [k for k in keys if k == 1]
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if not keys:
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return
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grid = np.linspace(0, 1, 501)
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fig = plt.figure(figsize=(10, 8))
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ax = fig.add_subplot(111)
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ax.plot([0, 1], [0, 1], linestyle="--", linewidth=1, color="grey")
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for k in keys:
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tprs = []
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aucs = []
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for _, curves in per_fold_curves:
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if k not in curves:
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continue
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fpr = curves[k]["fpr"]
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tpr = curves[k]["tpr"]
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aucs.append(curves[k]["auc"])
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tprs.append(np.interp(grid, fpr, tpr))
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if not tprs:
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continue
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tprs = np.vstack(tprs)
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mean = tprs.mean(axis=0)
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std = tprs.std(axis=0)
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label = class_names[k] if k < len(class_names) else f"class_{k}"
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label = f"{label} (AUC {np.nanmean(aucs):.3f}±{np.nanstd(aucs):.3f})"
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ax.plot(grid, mean, linewidth=2, label=label)
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ax.fill_between(grid, np.maximum(mean - std, 0), np.minimum(mean + std, 1), alpha=0.15)
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ax.set_xlabel("False Positive Rate")
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ax.set_ylabel("True Positive Rate")
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ax.set_title(f"Mean OVR ROC (±1 SD) — {head} head")
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ax.legend(loc="lower right")
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fig.tight_layout()
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suffix_str = suffix if suffix else ""
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out_dir.mkdir(parents=True, exist_ok=True)
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fig.savefig(out_dir / f"roc_{head}_mean_ovr{suffix_str}.png", dpi=160)
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plt.close(fig)
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def main():
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args = parse_args()
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run_dir = args.run_dir.resolve()
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cli_args = load_cli_args(run_dir)
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summary = load_summary(run_dir)
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class_names = (
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args.class_names
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if args.class_names
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else (cli_args.get("class_names") or (["Healthy", "Glaucoma"] if cli_args["eval_mode"] == "binary" else ["Healthy", "Glaucoma", "Suspect"]))
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)
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shortname = cli_args.get("shortname") or run_dir.parent.name
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run_id = cli_args.get("run_id") or run_dir.name
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base_models_dir = Path("models") / shortname / run_id
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clinical, holdout_df = prepare_clinical(cli_args, run_dir)
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if args.use_holdout and holdout_df is None:
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raise SystemExit("Holdout metrics requested but no holdout.csv found for this run.")
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per_fold_curves = []
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fold_aucs = []
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head = args.head
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file_suffix = "_holdout" if args.use_holdout else ""
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for fold_entry in summary.get("fold_metrics", []):
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fold_idx = int(fold_entry["fold"])
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best_epoch = fold_entry.get("best_epoch")
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if not best_epoch:
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print(f"[skip] Fold {fold_idx}: no best_epoch recorded.")
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continue
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# Prefer saved fold arrays when available. This avoids reconstructing
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# HyperTower for legacy runs whose external weight paths no longer exist.
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base = run_dir / f"fold{fold_idx}{file_suffix}"
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y_path = Path(f"{base}_y_true.npy")
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p_path = Path(f"{base}_probs_{legacy_probs_suffix(head)}.npy")
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if y_path.exists() and p_path.exists():
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y_true = np.load(y_path)
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head_probs = np.load(p_path)
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if cli_args["eval_mode"] == "binary" and head_probs.shape[1] >= 2:
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head_probs = head_probs[:, :2]
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curves = compute_per_class_curves(y_true, head_probs)
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per_fold_curves.append((fold_idx, curves))
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try:
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if head_probs.shape[1] > 2:
|
|
fold_auc = roc_auc_score(y_true, head_probs, multi_class="ovr", average="macro")
|
|
else:
|
|
target_scores = head_probs[:, 1] if head_probs.shape[1] > 1 else head_probs[:, 0]
|
|
fold_auc = roc_auc_score(y_true, target_scores)
|
|
fold_aucs.append(fold_auc)
|
|
print(
|
|
f"[info] Fold {fold_idx}: using saved arrays "
|
|
f"({y_path.name}, {p_path.name}), AUC={fold_auc:.4f}"
|
|
)
|
|
except Exception:
|
|
print(
|
|
f"[warning] Fold {fold_idx}: using saved arrays "
|
|
f"({y_path.name}, {p_path.name}) but AUC failed."
|
|
)
|
|
continue
|
|
|
|
fold_models_dir = base_models_dir / f"fold{fold_idx}"
|
|
best_checkpoint = fold_models_dir / "model_best.pt"
|
|
if not best_checkpoint.exists():
|
|
print(
|
|
f"[warning] Fold {fold_idx}: missing model_best.pt at {best_checkpoint} "
|
|
f"and missing fallback arrays {y_path.name}/{p_path.name}"
|
|
)
|
|
continue
|
|
|
|
ht_args = build_ht_args(cli_args, fold_idx, run_dir, fold_models_dir, holdout_df)
|
|
ht = HyperTower(clinical, ht_args)
|
|
for handler in list(ht.logger.handlers):
|
|
handler.close()
|
|
ht.logger.handlers = [logging.NullHandler()]
|
|
train_log_path = Path("train.log")
|
|
if train_log_path.exists() and train_log_path.stat().st_size == 0:
|
|
try:
|
|
train_log_path.unlink()
|
|
except OSError:
|
|
pass
|
|
try:
|
|
state = torch.load(best_checkpoint, map_location=ht.device, weights_only=False)
|
|
except TypeError:
|
|
state = torch.load(best_checkpoint, map_location=ht.device)
|
|
ht._restore_from_state(state)
|
|
if args.use_holdout:
|
|
eval_df = holdout_df.copy()
|
|
else:
|
|
_, eval_df = clinical.get_split_dfs(fold_idx)
|
|
if cli_args["eval_mode"] == "binary":
|
|
eval_df = eval_df[eval_df[cli_args["label_col"]].isin([0, 1])].reset_index(drop=True)
|
|
if eval_df.empty:
|
|
print(f"[warning] Fold {fold_idx}: evaluation dataframe is empty; skipping.")
|
|
continue
|
|
ht.test_loader = ht._make_loader_for_df(eval_df, is_train=False)
|
|
|
|
y_true, probs_f, probs_i, probs_m = collect_logits(ht, ht.test_loader)
|
|
if cli_args["eval_mode"] == "binary":
|
|
y_true, probs_f, probs_i, probs_m = ensure_binary_slice(y_true, probs_f, probs_i, probs_m)
|
|
|
|
head_probs = choose_head_probs(head, probs_f, probs_i, probs_m)
|
|
if head_probs is None:
|
|
print(f"[skip] Fold {fold_idx}: head '{head}' not available.")
|
|
continue
|
|
|
|
if head_probs.shape[1] >= 2:
|
|
head_probs = head_probs[:, :2]
|
|
|
|
if args.overwrite:
|
|
base = run_dir / f"fold{fold_idx}{file_suffix}"
|
|
np.save(f"{base}_y_true.npy", y_true)
|
|
if probs_f is not None:
|
|
np.save(f"{base}_probs_fused.npy", probs_f)
|
|
if probs_i is not None:
|
|
np.save(f"{base}_probs_img.npy", probs_i)
|
|
if probs_m is not None:
|
|
np.save(f"{base}_probs_md.npy", probs_m)
|
|
|
|
curves = compute_per_class_curves(y_true, head_probs)
|
|
per_fold_curves.append((fold_idx, curves))
|
|
try:
|
|
if head_probs.shape[1] > 2:
|
|
fold_auc = roc_auc_score(y_true, head_probs, multi_class="ovr", average="macro")
|
|
else:
|
|
target_scores = head_probs[:, 1] if head_probs.shape[1] > 1 else head_probs[:, 0]
|
|
fold_auc = roc_auc_score(y_true, target_scores)
|
|
fold_aucs.append(fold_auc)
|
|
print(f"[info] Fold {fold_idx}: best epoch {best_epoch}, AUC={fold_auc:.4f}")
|
|
except Exception:
|
|
print(f"[warning] Fold {fold_idx}: unable to compute AUC.")
|
|
|
|
if not per_fold_curves:
|
|
raise SystemExit("No folds processed; nothing to plot.")
|
|
|
|
plots_dir = run_dir / "plots"
|
|
plot_overlays(per_fold_curves, plots_dir, class_names, head, cli_args["eval_mode"], file_suffix)
|
|
plot_mean_sd(per_fold_curves, plots_dir, class_names, head, cli_args["eval_mode"], file_suffix)
|
|
|
|
if fold_aucs:
|
|
print(f"[info] {head} head mean AUC across folds: {np.mean(fold_aucs):.4f} ± {np.std(fold_aucs):.4f}")
|
|
print(f"Plots regenerated under {plots_dir}")
|
|
|
|
|
|
if __name__ == "__main__":
|
|
main()
|