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milk10k_effb2_metadata/__init__.py ADDED
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+ """EfficientNet-B2 dual-branch MILK10k metadata trainer."""
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+
milk10k_effb2_metadata/__pycache__/__init__.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/checkpoints.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/cli.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/data.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/losses.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/metrics.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/models.cpython-314.pyc ADDED
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milk10k_effb2_metadata/__pycache__/training.cpython-314.pyc ADDED
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milk10k_effb2_metadata/checkpoints.py ADDED
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1
+ """Checkpoint loading utilities for mixed timm/torchvision EfficientNet-B2 branches."""
2
+
3
+ from __future__ import annotations
4
+
5
+ import argparse
6
+ from pathlib import Path
7
+ from typing import Any
8
+
9
+ import torch
10
+ from torch import nn
11
+
12
+ CHECKPOINT_STATE_KEYS = ("model_state", "model_state_dict", "state_dict")
13
+ PREFIXES_TO_STRIP = ("module.", "model.", "_orig_mod.")
14
+
15
+
16
+ def extract_state_dict(checkpoint: Any) -> dict[str, torch.Tensor]:
17
+ if isinstance(checkpoint, dict):
18
+ for key in CHECKPOINT_STATE_KEYS:
19
+ value = checkpoint.get(key)
20
+ if isinstance(value, dict):
21
+ return value
22
+ if isinstance(checkpoint, dict) and all(torch.is_tensor(value) for value in checkpoint.values()):
23
+ return checkpoint
24
+ raise ValueError("Checkpoint does not contain a supported state dict.")
25
+
26
+
27
+ def load_raw_checkpoint(path: Path, device: torch.device, branch_name: str) -> Any:
28
+ if not path.exists():
29
+ raise FileNotFoundError(f"{branch_name} checkpoint not found: {path}")
30
+ try:
31
+ return torch.load(path, map_location=device, weights_only=False)
32
+ except TypeError:
33
+ return torch.load(path, map_location=device)
34
+
35
+
36
+ def normalize_key(key: str) -> str:
37
+ changed = True
38
+ while changed:
39
+ changed = False
40
+ for prefix in PREFIXES_TO_STRIP:
41
+ if key.startswith(prefix):
42
+ key = key.removeprefix(prefix)
43
+ changed = True
44
+ return key
45
+
46
+
47
+ def infer_checkpoint_backend(path: Path, device: torch.device, branch_name: str) -> str:
48
+ checkpoint = load_raw_checkpoint(path, device, branch_name)
49
+ state = extract_state_dict(checkpoint)
50
+ keys = {normalize_key(key) for key in state}
51
+ timm_prefixes = ("conv_stem.", "bn1.", "blocks.", "conv_head.", "bn2.")
52
+ torchvision_prefixes = ("features.", "avgpool.", "classifier.")
53
+ timm_hits = sum(key.startswith(timm_prefixes) for key in keys)
54
+ torchvision_hits = sum(key.startswith(torchvision_prefixes) for key in keys)
55
+ if timm_hits > torchvision_hits:
56
+ return "timm"
57
+ if torchvision_hits > timm_hits:
58
+ return "torchvision"
59
+ raise RuntimeError(
60
+ f"{branch_name}: cannot infer checkpoint backend from {path}. "
61
+ "Pass --backbone-backend timm or --backbone-backend torchvision explicitly."
62
+ )
63
+
64
+
65
+ def resolve_backbone_backends(args: argparse.Namespace, device: torch.device) -> tuple[str, str]:
66
+ if args.backbone_backend != "auto":
67
+ return args.backbone_backend, args.backbone_backend
68
+
69
+ clinical_backend = infer_checkpoint_backend(args.clinical_checkpoint, device, "clinical")
70
+ dermoscopic_backend = infer_checkpoint_backend(args.dermoscopic_checkpoint, device, "dermoscopic")
71
+ print(f"Auto-detected backbone backends: clinical={clinical_backend}, dermoscopic={dermoscopic_backend}")
72
+ return clinical_backend, dermoscopic_backend
73
+
74
+
75
+ def load_encoder_checkpoint(path: Path, encoder: nn.Module, branch_name: str, device: torch.device) -> None:
76
+ checkpoint = load_raw_checkpoint(path, device, branch_name)
77
+ raw_state = extract_state_dict(checkpoint)
78
+ source_state = {normalize_key(key): value for key, value in raw_state.items()}
79
+ target_state = encoder.state_dict()
80
+ matched = {
81
+ key: value
82
+ for key, value in source_state.items()
83
+ if key in target_state and tuple(value.shape) == tuple(target_state[key].shape)
84
+ }
85
+ skipped = len(source_state) - len(matched)
86
+ if not matched:
87
+ raise RuntimeError(f"{branch_name}: no matching encoder weights loaded from {path}")
88
+
89
+ target_state.update(matched)
90
+ encoder.load_state_dict(target_state)
91
+ print(f"{branch_name}: loaded {len(matched)} keys from {path}; skipped {skipped} keys")
92
+
milk10k_effb2_metadata/cli.py ADDED
@@ -0,0 +1,58 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ """CLI for the EfficientNet-B2 dual metadata trainer."""
2
+
3
+ from __future__ import annotations
4
+
5
+ import argparse
6
+ from pathlib import Path
7
+
8
+
9
+ def parse_args() -> argparse.Namespace:
10
+ parser = argparse.ArgumentParser(description="Train MILK10k dual EfficientNet-B2 with metadata fusion.")
11
+ parser.add_argument("--data-dir", type=Path, default=None)
12
+ parser.add_argument("--clinical-checkpoint", type=Path, required=True)
13
+ parser.add_argument("--dermoscopic-checkpoint", type=Path, required=True)
14
+ parser.add_argument("--output-dir", type=Path, default=Path("milk10k_dual_effb2_metadata_runs"))
15
+ parser.add_argument("--freeze-epochs", type=int, default=8)
16
+ parser.add_argument("--finetune-epochs", type=int, default=20)
17
+ parser.add_argument("--batch-size", type=int, default=8)
18
+ parser.add_argument("--image-size", type=int, default=260)
19
+ parser.add_argument(
20
+ "--num-workers",
21
+ type=int,
22
+ default=0,
23
+ help="DataLoader workers. Keep 0 in small Docker/Marimo containers to avoid /dev/shm exhaustion.",
24
+ )
25
+ parser.add_argument("--head-lr", type=float, default=1e-4)
26
+ parser.add_argument("--encoder-lr", type=float, default=1e-5)
27
+ parser.add_argument("--weight-decay", type=float, default=1e-4)
28
+ parser.add_argument("--val-size", type=float, default=0.20)
29
+ parser.add_argument("--seed", type=int, default=42)
30
+ parser.add_argument("--branch-dim", type=int, default=512)
31
+ parser.add_argument("--metadata-dim", type=int, default=64)
32
+ parser.add_argument("--classifier-hidden-dim", type=int, default=512)
33
+ parser.add_argument("--dropout", type=float, default=0.3)
34
+ parser.add_argument("--class-weight", action="store_true")
35
+ parser.add_argument("--weighted-sampler", action="store_true")
36
+ parser.add_argument("--sampler-power", type=float, default=1.0)
37
+ parser.add_argument("--loss", choices=["ce", "focal", "milk_lt"], default="ce")
38
+ parser.add_argument("--focal-gamma", type=float, default=2.0)
39
+ parser.add_argument("--lt-beta", type=float, default=0.9999)
40
+ parser.add_argument("--lt-max-margin", type=float, default=0.5)
41
+ parser.add_argument("--lt-logit-tau", type=float, default=1.0)
42
+ parser.add_argument("--lt-draw-start-epoch", "--lt-drw-start-epoch", dest="lt_draw_start_epoch", type=int, default=0)
43
+ parser.add_argument("--lt-alpha-max", type=float, default=10.0)
44
+ parser.add_argument("--k-folds", type=int, default=1)
45
+ parser.add_argument("--amp", action="store_true")
46
+ parser.add_argument(
47
+ "--backbone-backend",
48
+ choices=["auto", "timm", "torchvision"],
49
+ default="auto",
50
+ help="Backbone implementation used by checkpoints. auto detects timm vs torchvision from checkpoint keys.",
51
+ )
52
+ parser.add_argument(
53
+ "--imagenet-pretrained",
54
+ action="store_true",
55
+ help="Initialize EfficientNet-B2 with ImageNet weights before loading branch checkpoints.",
56
+ )
57
+ parser.add_argument("--patience", type=int, default=6)
58
+ return parser.parse_args()
milk10k_effb2_metadata/data.py ADDED
@@ -0,0 +1,262 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ """Dataframe, metadata, split, and dataloader helpers."""
2
+
3
+ from __future__ import annotations
4
+
5
+ import argparse
6
+ from pathlib import Path
7
+ from typing import Any
8
+
9
+ import numpy as np
10
+ import pandas as pd
11
+ import torch
12
+ from PIL import Image, ImageFile
13
+ from sklearn.model_selection import StratifiedKFold, train_test_split
14
+ from torch.utils.data import DataLoader, Dataset, WeightedRandomSampler
15
+ from torchvision import transforms
16
+
17
+ from datasets import LABEL_COLUMNS, normalize_image_type
18
+
19
+ ImageFile.LOAD_TRUNCATED_IMAGES = True
20
+
21
+ METADATA_COLUMNS = ("age_approx", "sex", "skin_tone_class", "site")
22
+
23
+
24
+ class PairedMilk10kMetadataDataset(Dataset):
25
+ def __init__(
26
+ self,
27
+ df: pd.DataFrame,
28
+ label_to_idx: dict[str, int],
29
+ metadata_spec: dict[str, Any],
30
+ transform=None,
31
+ ) -> None:
32
+ self.df = df.reset_index(drop=True)
33
+ self.labels = [label_to_idx[label] for label in self.df["label"].tolist()]
34
+ self.metadata = np.stack([metadata_vector(row, metadata_spec) for _, row in self.df.iterrows()])
35
+ self.transform = transform
36
+
37
+ def __len__(self) -> int:
38
+ return len(self.df)
39
+
40
+ def _load_image(self, path: str) -> torch.Tensor:
41
+ with Image.open(path) as img:
42
+ image = img.convert("RGB")
43
+ if self.transform is not None:
44
+ image = self.transform(image)
45
+ return image
46
+
47
+ def __getitem__(self, idx: int) -> dict[str, torch.Tensor]:
48
+ row = self.df.iloc[idx]
49
+ return {
50
+ "clinical": self._load_image(row["clinical_path"]),
51
+ "dermoscopic": self._load_image(row["dermoscopic_path"]),
52
+ "metadata": torch.from_numpy(self.metadata[idx]),
53
+ "label": torch.tensor(self.labels[idx], dtype=torch.long),
54
+ }
55
+
56
+
57
+ def load_paired_dataframe(data_dir: Path) -> pd.DataFrame:
58
+ input_dir = data_dir / "MILK10k_Training_Input"
59
+ gt = pd.read_csv(data_dir / "MILK10k_Training_GroundTruth.csv")
60
+ meta = pd.read_csv(data_dir / "MILK10k_Training_Metadata.csv")
61
+ monet_columns = resolve_monet_columns(meta)
62
+
63
+ gt["label"] = gt[LABEL_COLUMNS].idxmax(axis=1)
64
+ meta["image_type_norm"] = meta["image_type"].map(normalize_image_type)
65
+ meta["path"] = meta.apply(lambda r: input_dir / r["lesion_id"] / f"{r['isic_id']}.jpg", axis=1)
66
+ meta = meta[meta["path"].map(lambda p: p.exists())].copy()
67
+ meta["path"] = meta["path"].map(str)
68
+
69
+ keep = ["lesion_id", "path", *METADATA_COLUMNS, *monet_columns]
70
+ clinical = meta[meta["image_type_norm"] == "clinical_close_up"][keep].drop_duplicates("lesion_id")
71
+ dermoscopic = meta[meta["image_type_norm"] == "dermoscopic"][keep].drop_duplicates("lesion_id")
72
+ paired = (
73
+ gt[["lesion_id", "label"]]
74
+ .merge(clinical.add_prefix("clinical_"), left_on="lesion_id", right_on="clinical_lesion_id")
75
+ .merge(dermoscopic.add_prefix("dermoscopic_"), left_on="lesion_id", right_on="dermoscopic_lesion_id")
76
+ .drop(columns=["clinical_lesion_id", "dermoscopic_lesion_id"])
77
+ )
78
+ if paired.empty:
79
+ raise ValueError(f"No paired clinical/dermoscopic lesions found under {input_dir}")
80
+ return paired
81
+
82
+
83
+ def resolve_monet_columns(meta: pd.DataFrame) -> list[str]:
84
+ try:
85
+ from milk10k_dual_encoder.config import MONET_COLUMNS
86
+
87
+ configured = [column for column in MONET_COLUMNS if column in meta.columns]
88
+ if configured:
89
+ return configured
90
+ except Exception:
91
+ pass
92
+ return sorted(column for column in meta.columns if column.startswith("MONET_"))
93
+
94
+
95
+ def lesion_split(df: pd.DataFrame, val_size: float, seed: int) -> tuple[pd.DataFrame, pd.DataFrame]:
96
+ lesion_df = df[["lesion_id", "label"]].drop_duplicates("lesion_id")
97
+ train_lesions, val_lesions = train_test_split(
98
+ lesion_df,
99
+ test_size=val_size,
100
+ stratify=lesion_df["label"],
101
+ random_state=seed,
102
+ )
103
+ return split_by_lesion_ids(df, train_lesions["lesion_id"], val_lesions["lesion_id"])
104
+
105
+
106
+ def kfold_splits(df: pd.DataFrame, k_folds: int, seed: int) -> list[tuple[pd.DataFrame, pd.DataFrame]]:
107
+ if k_folds < 2:
108
+ raise ValueError("--k-folds must be 1 for single split or at least 2 for k-fold training.")
109
+
110
+ lesion_df = df[["lesion_id", "label"]].drop_duplicates("lesion_id").reset_index(drop=True)
111
+ min_class_count = int(lesion_df["label"].value_counts().min())
112
+ if k_folds > min_class_count:
113
+ raise ValueError(
114
+ f"--k-folds={k_folds} is larger than the smallest class count ({min_class_count}). "
115
+ "Use fewer folds or merge/remove ultra-rare classes."
116
+ )
117
+
118
+ splitter = StratifiedKFold(n_splits=k_folds, shuffle=True, random_state=seed)
119
+ splits = []
120
+ for train_idx, val_idx in splitter.split(lesion_df["lesion_id"], lesion_df["label"]):
121
+ train_lesions = lesion_df.iloc[train_idx]["lesion_id"]
122
+ val_lesions = lesion_df.iloc[val_idx]["lesion_id"]
123
+ splits.append(split_by_lesion_ids(df, train_lesions, val_lesions))
124
+ return splits
125
+
126
+
127
+ def split_by_lesion_ids(
128
+ df: pd.DataFrame,
129
+ train_lesions: pd.Series,
130
+ val_lesions: pd.Series,
131
+ ) -> tuple[pd.DataFrame, pd.DataFrame]:
132
+ return (
133
+ df[df["lesion_id"].isin(train_lesions)].copy(),
134
+ df[df["lesion_id"].isin(val_lesions)].copy(),
135
+ )
136
+
137
+
138
+ def fit_metadata_spec(train_df: pd.DataFrame) -> dict[str, Any]:
139
+ sex_values = sorted({"unknown"} | collect_string_values(train_df, "sex"))
140
+ site_values = sorted({"unknown"} | collect_string_values(train_df, "site"))
141
+ return {
142
+ "sex_values": sex_values,
143
+ "site_values": site_values,
144
+ "monet_columns": infer_paired_monet_columns(train_df),
145
+ }
146
+
147
+
148
+ def collect_string_values(df: pd.DataFrame, field: str) -> set[str]:
149
+ values: set[str] = set()
150
+ for prefix in ("clinical", "dermoscopic"):
151
+ series = df[f"{prefix}_{field}"].fillna("unknown").astype(str).str.strip()
152
+ values.update(value if value else "unknown" for value in series.tolist())
153
+ return values
154
+
155
+
156
+ def infer_paired_monet_columns(df: pd.DataFrame) -> list[str]:
157
+ clinical_prefix = "clinical_MONET_"
158
+ return sorted(
159
+ column.removeprefix("clinical_")
160
+ for column in df.columns
161
+ if column.startswith(clinical_prefix) and f"dermoscopic_{column.removeprefix('clinical_')}" in df.columns
162
+ )
163
+
164
+
165
+ def metadata_vector(row: pd.Series, spec: dict[str, Any]) -> np.ndarray:
166
+ age = first_numeric(row, "age_approx")
167
+ skin_tone = first_numeric(row, "skin_tone_class")
168
+ sex = first_string(row, "sex")
169
+ site = first_string(row, "site")
170
+
171
+ values: list[float] = [
172
+ 0.0 if age is None else float(age) / 100.0,
173
+ 0.0 if skin_tone is None else float(skin_tone) / 6.0,
174
+ ]
175
+ values.extend(1.0 if sex == item else 0.0 for item in spec["sex_values"])
176
+ values.extend(1.0 if site == item else 0.0 for item in spec["site_values"])
177
+
178
+ for prefix in ("clinical", "dermoscopic"):
179
+ for column in spec.get("monet_columns", []):
180
+ value = pd.to_numeric(row.get(f"{prefix}_{column}"), errors="coerce")
181
+ values.append(0.0 if pd.isna(value) else float(value))
182
+
183
+ return np.asarray(values, dtype=np.float32)
184
+
185
+
186
+ def first_numeric(row: pd.Series, field: str) -> float | None:
187
+ for prefix in ("clinical", "dermoscopic"):
188
+ value = pd.to_numeric(row.get(f"{prefix}_{field}"), errors="coerce")
189
+ if not pd.isna(value):
190
+ return float(value)
191
+ return None
192
+
193
+
194
+ def first_string(row: pd.Series, field: str) -> str:
195
+ for prefix in ("clinical", "dermoscopic"):
196
+ value = row.get(f"{prefix}_{field}")
197
+ if pd.notna(value):
198
+ value = str(value).strip()
199
+ if value:
200
+ return value
201
+ return "unknown"
202
+
203
+
204
+ def make_transforms(image_size: int):
205
+ normalize = transforms.Normalize(mean=[0.485, 0.456, 0.406], std=[0.229, 0.224, 0.225])
206
+ train_transform = transforms.Compose(
207
+ [
208
+ transforms.Resize((image_size, image_size)),
209
+ transforms.RandomHorizontalFlip(),
210
+ transforms.RandomVerticalFlip(),
211
+ transforms.RandomRotation(20),
212
+ transforms.ColorJitter(brightness=0.2, contrast=0.2, saturation=0.2),
213
+ transforms.ToTensor(),
214
+ normalize,
215
+ ]
216
+ )
217
+ eval_transform = transforms.Compose(
218
+ [
219
+ transforms.Resize((image_size, image_size)),
220
+ transforms.ToTensor(),
221
+ normalize,
222
+ ]
223
+ )
224
+ return train_transform, eval_transform
225
+
226
+
227
+ def make_loaders(
228
+ train_df: pd.DataFrame,
229
+ val_df: pd.DataFrame,
230
+ label_to_idx: dict[str, int],
231
+ metadata_spec: dict[str, Any],
232
+ args: argparse.Namespace,
233
+ ) -> tuple[DataLoader, DataLoader]:
234
+ train_transform, eval_transform = make_transforms(args.image_size)
235
+ train_ds = PairedMilk10kMetadataDataset(train_df, label_to_idx, metadata_spec, train_transform)
236
+ val_ds = PairedMilk10kMetadataDataset(val_df, label_to_idx, metadata_spec, eval_transform)
237
+ common = dict(
238
+ batch_size=args.batch_size,
239
+ num_workers=args.num_workers,
240
+ pin_memory=torch.cuda.is_available(),
241
+ drop_last=False,
242
+ )
243
+ sampler = build_weighted_sampler(train_ds, args) if args.weighted_sampler else None
244
+ train_loader = DataLoader(train_ds, shuffle=sampler is None, sampler=sampler, **common)
245
+ val_loader = DataLoader(val_ds, shuffle=False, **common)
246
+ return train_loader, val_loader
247
+
248
+
249
+ def build_weighted_sampler(
250
+ dataset: PairedMilk10kMetadataDataset,
251
+ args: argparse.Namespace,
252
+ ) -> WeightedRandomSampler:
253
+ labels = np.asarray(dataset.labels)
254
+ counts = np.bincount(labels)
255
+ if np.any(counts == 0):
256
+ raise ValueError("Cannot build weighted sampler because at least one class has zero training samples.")
257
+ class_weights = 1.0 / np.power(counts.astype(np.float64), args.sampler_power)
258
+ sample_weights = torch.as_tensor(class_weights[labels], dtype=torch.double)
259
+ generator = torch.Generator()
260
+ generator.manual_seed(args.seed)
261
+ return WeightedRandomSampler(sample_weights, num_samples=len(dataset), replacement=True, generator=generator)
262
+
milk10k_effb2_metadata/losses.py ADDED
@@ -0,0 +1,111 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ """Classification losses for the EffB2 metadata trainer."""
2
+
3
+ from __future__ import annotations
4
+
5
+ import argparse
6
+
7
+ import numpy as np
8
+ import pandas as pd
9
+ import torch
10
+ import torch.nn.functional as F
11
+ from sklearn.utils.class_weight import compute_class_weight
12
+ from torch import nn
13
+
14
+
15
+ class FocalLoss(nn.Module):
16
+ def __init__(self, weight: torch.Tensor | None = None, gamma: float = 2.0) -> None:
17
+ super().__init__()
18
+ self.weight = weight
19
+ self.gamma = gamma
20
+
21
+ def forward(self, logits: torch.Tensor, labels: torch.Tensor) -> torch.Tensor:
22
+ ce = F.cross_entropy(logits, labels, reduction="none")
23
+ pt = torch.exp(-ce)
24
+ loss = (1.0 - pt) ** self.gamma * ce
25
+ if self.weight is not None:
26
+ loss = loss * self.weight[labels]
27
+ return loss.mean()
28
+
29
+
30
+ class MILKLongTailLoss(nn.Module):
31
+ """LDAM + balanced-softmax/logit adjustment + deferred effective-number alpha."""
32
+
33
+ def __init__(
34
+ self,
35
+ class_counts: torch.Tensor,
36
+ beta: float = 0.9999,
37
+ max_margin: float = 0.5,
38
+ logit_tau: float = 1.0,
39
+ deferred_start_epoch: int = 0,
40
+ alpha_max: float = 10.0,
41
+ ) -> None:
42
+ super().__init__()
43
+ counts = class_counts.float().clamp_min(1.0)
44
+ margins = 1.0 / torch.sqrt(torch.sqrt(counts))
45
+ margins = margins * (max_margin / margins.max().clamp_min(1e-12))
46
+ priors = counts / counts.sum()
47
+ alpha = effective_number_alpha(counts, beta)
48
+ alpha = alpha.clamp(max=alpha_max)
49
+ alpha = alpha * (counts.numel() / alpha.sum().clamp_min(1e-12))
50
+
51
+ self.register_buffer("margins", margins)
52
+ self.register_buffer("log_priors", priors.log())
53
+ self.register_buffer("alpha", alpha)
54
+ self.logit_tau = logit_tau
55
+ self.deferred_start_epoch = deferred_start_epoch
56
+ self.current_epoch = 0
57
+
58
+ def set_epoch(self, epoch: int) -> None:
59
+ self.current_epoch = epoch
60
+
61
+ def forward(self, logits: torch.Tensor, labels: torch.Tensor) -> torch.Tensor:
62
+ adjusted_logits = logits.clone()
63
+ rows = torch.arange(labels.size(0), device=labels.device)
64
+ adjusted_logits[rows, labels] = adjusted_logits[rows, labels] - self.margins[labels]
65
+ adjusted_logits = adjusted_logits + self.logit_tau * self.log_priors
66
+ loss = F.cross_entropy(adjusted_logits, labels, reduction="none")
67
+ if self.current_epoch >= self.deferred_start_epoch:
68
+ loss = loss * self.alpha[labels]
69
+ return loss.mean()
70
+
71
+
72
+ def effective_number_alpha(counts: torch.Tensor, beta: float) -> torch.Tensor:
73
+ if beta <= 0.0:
74
+ return torch.ones_like(counts)
75
+ if beta >= 1.0:
76
+ raise ValueError("--lt-beta must be less than 1.0")
77
+ beta_tensor = torch.tensor(beta, dtype=counts.dtype, device=counts.device)
78
+ effective_num = 1.0 - torch.pow(beta_tensor, counts)
79
+ alpha = (1.0 - beta_tensor) / effective_num.clamp_min(1e-12)
80
+ return alpha
81
+
82
+
83
+ def class_count_tensor(train_df: pd.DataFrame, label_to_idx: dict[str, int], device: torch.device) -> torch.Tensor:
84
+ y = np.array([label_to_idx[label] for label in train_df["label"]])
85
+ counts = np.bincount(y, minlength=len(label_to_idx))
86
+ if np.any(counts == 0):
87
+ missing = [label for label, idx in label_to_idx.items() if counts[idx] == 0]
88
+ raise ValueError(f"Cannot build loss because train split has zero samples for classes: {missing}")
89
+ return torch.tensor(counts, dtype=torch.float32, device=device)
90
+
91
+
92
+ def build_loss(train_df: pd.DataFrame, label_to_idx: dict[str, int], args: argparse.Namespace, device: torch.device) -> nn.Module:
93
+ if args.loss == "milk_lt":
94
+ counts = class_count_tensor(train_df, label_to_idx, device)
95
+ return MILKLongTailLoss(
96
+ class_counts=counts,
97
+ beta=args.lt_beta,
98
+ max_margin=args.lt_max_margin,
99
+ logit_tau=args.lt_logit_tau,
100
+ deferred_start_epoch=args.lt_draw_start_epoch,
101
+ alpha_max=args.lt_alpha_max,
102
+ )
103
+
104
+ weight = None
105
+ if args.class_weight:
106
+ y = np.array([label_to_idx[label] for label in train_df["label"]])
107
+ weights = compute_class_weight(class_weight="balanced", classes=np.arange(len(label_to_idx)), y=y)
108
+ weight = torch.tensor(weights, dtype=torch.float32, device=device)
109
+ if args.loss == "focal":
110
+ return FocalLoss(weight=weight, gamma=args.focal_gamma)
111
+ return nn.CrossEntropyLoss(weight=weight)
milk10k_effb2_metadata/metrics.py ADDED
@@ -0,0 +1,144 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ """Prediction and classification metric helpers."""
2
+
3
+ from __future__ import annotations
4
+
5
+ from pathlib import Path
6
+ from typing import Any
7
+
8
+ import numpy as np
9
+ import pandas as pd
10
+ import torch
11
+ from sklearn.metrics import (
12
+ accuracy_score,
13
+ balanced_accuracy_score,
14
+ classification_report,
15
+ confusion_matrix,
16
+ precision_recall_fscore_support,
17
+ roc_auc_score,
18
+ )
19
+ from sklearn.preprocessing import label_binarize
20
+ from torch.utils.data import DataLoader
21
+ from tqdm.auto import tqdm
22
+
23
+ from milk10k_effb2_metadata.models import DualEffB2MetadataClassifier
24
+
25
+
26
+ def move_batch(batch: dict[str, torch.Tensor], device: torch.device) -> tuple[torch.Tensor, torch.Tensor, torch.Tensor, torch.Tensor]:
27
+ clinical = batch["clinical"].to(device, non_blocking=True)
28
+ dermoscopic = batch["dermoscopic"].to(device, non_blocking=True)
29
+ metadata = batch["metadata"].to(device, non_blocking=True)
30
+ labels = batch["label"].to(device, non_blocking=True)
31
+ return clinical, dermoscopic, metadata, labels
32
+
33
+
34
+ @torch.no_grad()
35
+ def predict(model: DualEffB2MetadataClassifier, loader: DataLoader, device: torch.device) -> tuple[np.ndarray, np.ndarray]:
36
+ model.eval()
37
+ labels_all = []
38
+ probs_all = []
39
+ for batch in tqdm(loader, leave=False):
40
+ clinical, dermoscopic, metadata, labels = move_batch(batch, device)
41
+ logits = model(clinical, dermoscopic, metadata)
42
+ labels_all.append(labels.cpu().numpy())
43
+ probs_all.append(torch.softmax(logits, dim=1).cpu().numpy())
44
+ return np.concatenate(labels_all), np.concatenate(probs_all)
45
+
46
+
47
+ def compute_metrics(y_true: np.ndarray, y_prob: np.ndarray, class_names: list[str]) -> tuple[dict[str, Any], pd.DataFrame, np.ndarray]:
48
+ y_pred = y_prob.argmax(axis=1)
49
+ labels = list(range(len(class_names)))
50
+ y_true_bin = label_binarize(y_true, classes=labels)
51
+ cm = confusion_matrix(y_true, y_pred, labels=labels)
52
+
53
+ precision_macro, recall_macro, f1_macro, _ = precision_recall_fscore_support(
54
+ y_true, y_pred, labels=labels, average="macro", zero_division=0
55
+ )
56
+ precision_weighted, recall_weighted, f1_weighted, _ = precision_recall_fscore_support(
57
+ y_true, y_pred, labels=labels, average="weighted", zero_division=0
58
+ )
59
+ precision_per_class, recall_per_class, f1_per_class, support_per_class = precision_recall_fscore_support(
60
+ y_true, y_pred, labels=labels, average=None, zero_division=0
61
+ )
62
+
63
+ total = cm.sum()
64
+ per_class_rows = []
65
+ for idx, class_name in enumerate(class_names):
66
+ tp = int(cm[idx, idx])
67
+ fn = int(cm[idx, :].sum() - tp)
68
+ fp = int(cm[:, idx].sum() - tp)
69
+ tn = int(total - tp - fn - fp)
70
+ try:
71
+ auc_ovr = float(roc_auc_score(y_true_bin[:, idx], y_prob[:, idx]))
72
+ except ValueError:
73
+ auc_ovr = None
74
+ per_class_rows.append(
75
+ {
76
+ "class": class_name,
77
+ "support": int(support_per_class[idx]),
78
+ "precision": float(precision_per_class[idx]),
79
+ "recall_sensitivity": float(recall_per_class[idx]),
80
+ "specificity": tn / (tn + fp) if (tn + fp) else 0.0,
81
+ "f1": float(f1_per_class[idx]),
82
+ "auc_ovr": auc_ovr,
83
+ }
84
+ )
85
+
86
+ metrics = {
87
+ "accuracy": float(accuracy_score(y_true, y_pred)),
88
+ "balanced_accuracy": float(balanced_accuracy_score(y_true, y_pred)),
89
+ "top2_accuracy": float(np.mean((np.argsort(y_prob, axis=1)[:, -min(2, len(class_names)) :] == y_true[:, None]).any(axis=1))),
90
+ "top3_accuracy": float(np.mean((np.argsort(y_prob, axis=1)[:, -min(3, len(class_names)) :] == y_true[:, None]).any(axis=1))),
91
+ "precision_macro": float(precision_macro),
92
+ "recall_macro": float(recall_macro),
93
+ "f1_macro": float(f1_macro),
94
+ "precision_weighted": float(precision_weighted),
95
+ "recall_weighted": float(recall_weighted),
96
+ "f1_weighted": float(f1_weighted),
97
+ "roc_auc_macro_ovr": safe_roc_auc(y_true_bin, y_prob, "macro"),
98
+ "roc_auc_weighted_ovr": safe_roc_auc(y_true_bin, y_prob, "weighted"),
99
+ "roc_auc_micro_ovr": safe_roc_auc(y_true_bin, y_prob, "micro"),
100
+ "specificity_macro": float(np.mean([row["specificity"] for row in per_class_rows])),
101
+ "per_class": per_class_rows,
102
+ "classification_report": classification_report(
103
+ y_true,
104
+ y_pred,
105
+ labels=labels,
106
+ target_names=class_names,
107
+ zero_division=0,
108
+ output_dict=True,
109
+ ),
110
+ "class_names": class_names,
111
+ }
112
+ return metrics, pd.DataFrame(per_class_rows), cm
113
+
114
+
115
+ def safe_roc_auc(y_true_bin: np.ndarray, y_prob: np.ndarray, average: str | None) -> float | None:
116
+ try:
117
+ return float(roc_auc_score(y_true_bin, y_prob, average=average, multi_class="ovr"))
118
+ except ValueError:
119
+ return None
120
+
121
+
122
+ def save_predictions(
123
+ val_df: pd.DataFrame,
124
+ y_true: np.ndarray,
125
+ y_prob: np.ndarray,
126
+ class_names: list[str],
127
+ output_dir: Path,
128
+ ) -> None:
129
+ y_pred = y_prob.argmax(axis=1)
130
+ prediction_df = pd.DataFrame(
131
+ {
132
+ "lesion_id": val_df["lesion_id"].tolist(),
133
+ "clinical_path": val_df["clinical_path"].tolist(),
134
+ "dermoscopic_path": val_df["dermoscopic_path"].tolist(),
135
+ "y_true": y_true,
136
+ "y_pred": y_pred,
137
+ "label_true": [class_names[idx] for idx in y_true],
138
+ "label_pred": [class_names[idx] for idx in y_pred],
139
+ "confidence": y_prob.max(axis=1),
140
+ }
141
+ )
142
+ probability_df = pd.DataFrame(y_prob, columns=[f"prob_{name}" for name in class_names])
143
+ pd.concat([prediction_df, probability_df], axis=1).to_csv(output_dir / "val_predictions.csv", index=False)
144
+
milk10k_effb2_metadata/models.py ADDED
@@ -0,0 +1,122 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ """Model components for the dual EfficientNet-B2 metadata classifier."""
2
+
3
+ from __future__ import annotations
4
+
5
+ import timm
6
+ import torch
7
+ from torch import nn
8
+ from torchvision.models import EfficientNet_B2_Weights, efficientnet_b2
9
+
10
+
11
+ class ProjectionHead(nn.Module):
12
+ def __init__(self, in_dim: int, out_dim: int, dropout: float) -> None:
13
+ super().__init__()
14
+ self.net = nn.Sequential(
15
+ nn.LayerNorm(in_dim),
16
+ nn.Dropout(dropout),
17
+ nn.Linear(in_dim, out_dim),
18
+ nn.GELU(),
19
+ nn.LayerNorm(out_dim),
20
+ )
21
+
22
+ def forward(self, x: torch.Tensor) -> torch.Tensor:
23
+ return self.net(x)
24
+
25
+
26
+ class MetadataHead(nn.Module):
27
+ def __init__(self, in_dim: int, out_dim: int, dropout: float) -> None:
28
+ super().__init__()
29
+ hidden_dim = max(out_dim * 2, 32)
30
+ self.net = nn.Sequential(
31
+ nn.LayerNorm(in_dim),
32
+ nn.Linear(in_dim, hidden_dim),
33
+ nn.GELU(),
34
+ nn.Dropout(dropout),
35
+ nn.Linear(hidden_dim, out_dim),
36
+ nn.GELU(),
37
+ nn.LayerNorm(out_dim),
38
+ )
39
+
40
+ def forward(self, metadata: torch.Tensor) -> torch.Tensor:
41
+ return self.net(metadata)
42
+
43
+
44
+ class DualEffB2MetadataClassifier(nn.Module):
45
+ def __init__(
46
+ self,
47
+ num_classes: int,
48
+ metadata_input_dim: int,
49
+ branch_dim: int,
50
+ metadata_dim: int,
51
+ classifier_hidden_dim: int,
52
+ dropout: float,
53
+ imagenet_pretrained: bool,
54
+ clinical_backbone_backend: str,
55
+ dermoscopic_backbone_backend: str,
56
+ ) -> None:
57
+ super().__init__()
58
+ self.clinical_backbone_backend = clinical_backbone_backend
59
+ self.dermoscopic_backbone_backend = dermoscopic_backbone_backend
60
+ self.clinical_encoder, clinical_feature_dim = build_effb2_feature_encoder(
61
+ clinical_backbone_backend,
62
+ imagenet_pretrained,
63
+ )
64
+ self.dermoscopic_encoder, dermoscopic_feature_dim = build_effb2_feature_encoder(
65
+ dermoscopic_backbone_backend,
66
+ imagenet_pretrained,
67
+ )
68
+
69
+ self.clinical_head = ProjectionHead(clinical_feature_dim, branch_dim, dropout)
70
+ self.dermoscopic_head = ProjectionHead(dermoscopic_feature_dim, branch_dim, dropout)
71
+ self.metadata_head = MetadataHead(metadata_input_dim, metadata_dim, dropout)
72
+ fused_dim = branch_dim * 2 + metadata_dim
73
+ self.classifier = nn.Sequential(
74
+ nn.LayerNorm(fused_dim),
75
+ nn.Dropout(dropout),
76
+ nn.Linear(fused_dim, classifier_hidden_dim),
77
+ nn.GELU(),
78
+ nn.Dropout(dropout),
79
+ nn.Linear(classifier_hidden_dim, num_classes),
80
+ )
81
+
82
+ def forward(
83
+ self,
84
+ clinical: torch.Tensor,
85
+ dermoscopic: torch.Tensor,
86
+ metadata: torch.Tensor,
87
+ ) -> torch.Tensor:
88
+ clinical_features = self.clinical_encoder(clinical)
89
+ dermoscopic_features = self.dermoscopic_encoder(dermoscopic)
90
+ clinical_repr = self.clinical_head(clinical_features)
91
+ dermoscopic_repr = self.dermoscopic_head(dermoscopic_features)
92
+ metadata_repr = self.metadata_head(metadata)
93
+ fused = torch.cat([clinical_repr, dermoscopic_repr, metadata_repr], dim=1)
94
+ return self.classifier(fused)
95
+
96
+
97
+ def build_effb2_feature_encoder(backbone_backend: str, imagenet_pretrained: bool) -> tuple[nn.Module, int]:
98
+ if backbone_backend == "timm":
99
+ model = timm.create_model(
100
+ "efficientnet_b2",
101
+ pretrained=imagenet_pretrained,
102
+ num_classes=0,
103
+ global_pool="avg",
104
+ )
105
+ return model, int(model.num_features)
106
+
107
+ if backbone_backend == "torchvision":
108
+ weights = EfficientNet_B2_Weights.IMAGENET1K_V1 if imagenet_pretrained else None
109
+ model = efficientnet_b2(weights=weights)
110
+ feature_dim = int(model.classifier[1].in_features)
111
+ model.classifier = nn.Identity()
112
+ return model, feature_dim
113
+
114
+ raise ValueError(f"Unsupported backbone backend: {backbone_backend}")
115
+
116
+
117
+ def set_encoder_trainable(model: DualEffB2MetadataClassifier, trainable: bool) -> None:
118
+ for param in model.clinical_encoder.parameters():
119
+ param.requires_grad = trainable
120
+ for param in model.dermoscopic_encoder.parameters():
121
+ param.requires_grad = trainable
122
+
milk10k_effb2_metadata/training.py ADDED
@@ -0,0 +1,502 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ """Training orchestration for the EffB2 dual metadata classifier."""
2
+
3
+ from __future__ import annotations
4
+
5
+ import argparse
6
+ import json
7
+ from pathlib import Path
8
+ from typing import Any
9
+
10
+ import numpy as np
11
+ import pandas as pd
12
+ import torch
13
+ from sklearn.metrics import balanced_accuracy_score, precision_recall_fscore_support
14
+ from torch import nn
15
+ from torch.amp import GradScaler, autocast
16
+ from torch.utils.data import DataLoader
17
+ from tqdm.auto import tqdm
18
+
19
+ from datasets import resolve_data_dir, set_seed
20
+ from milk10k_effb2_metadata.checkpoints import load_encoder_checkpoint, resolve_backbone_backends
21
+ from milk10k_effb2_metadata.data import (
22
+ fit_metadata_spec,
23
+ kfold_splits,
24
+ lesion_split,
25
+ load_paired_dataframe,
26
+ make_loaders,
27
+ metadata_vector,
28
+ )
29
+ from milk10k_effb2_metadata.losses import build_loss
30
+ from milk10k_effb2_metadata.metrics import compute_metrics, move_batch, predict, save_predictions
31
+ from milk10k_effb2_metadata.models import DualEffB2MetadataClassifier, set_encoder_trainable
32
+
33
+
34
+ def build_optimizer(model: DualEffB2MetadataClassifier, args: argparse.Namespace, encoders_trainable: bool) -> torch.optim.Optimizer:
35
+ head_params = []
36
+ encoder_params = []
37
+ for name, param in model.named_parameters():
38
+ if not param.requires_grad:
39
+ continue
40
+ if name.startswith(("clinical_encoder.", "dermoscopic_encoder.")):
41
+ encoder_params.append(param)
42
+ else:
43
+ head_params.append(param)
44
+
45
+ groups = [{"params": head_params, "lr": args.head_lr}]
46
+ if encoders_trainable and encoder_params:
47
+ groups.append({"params": encoder_params, "lr": args.encoder_lr})
48
+ return torch.optim.AdamW(groups, weight_decay=args.weight_decay)
49
+
50
+
51
+ def run_epoch(
52
+ model: DualEffB2MetadataClassifier,
53
+ loader: DataLoader,
54
+ criterion: nn.Module,
55
+ device: torch.device,
56
+ optimizer: torch.optim.Optimizer | None = None,
57
+ scaler: GradScaler | None = None,
58
+ use_amp: bool = False,
59
+ ) -> dict[str, float]:
60
+ training = optimizer is not None
61
+ model.train(training)
62
+ total_loss = 0.0
63
+ correct = 0
64
+ top3_correct = 0
65
+ total = 0
66
+ preds_all = []
67
+ labels_all = []
68
+
69
+ for batch in tqdm(loader, leave=False):
70
+ clinical, dermoscopic, metadata, labels = move_batch(batch, device)
71
+ if training:
72
+ optimizer.zero_grad(set_to_none=True)
73
+
74
+ with torch.set_grad_enabled(training):
75
+ with autocast("cuda", enabled=use_amp):
76
+ logits = model(clinical, dermoscopic, metadata)
77
+ loss = criterion(logits, labels)
78
+ if training:
79
+ if scaler is not None and use_amp:
80
+ scaler.scale(loss).backward()
81
+ scaler.unscale_(optimizer)
82
+ torch.nn.utils.clip_grad_norm_(model.parameters(), max_norm=1.0)
83
+ scaler.step(optimizer)
84
+ scaler.update()
85
+ else:
86
+ loss.backward()
87
+ torch.nn.utils.clip_grad_norm_(model.parameters(), max_norm=1.0)
88
+ optimizer.step()
89
+
90
+ batch_size = labels.size(0)
91
+ total_loss += float(loss.detach().item()) * batch_size
92
+ correct += (logits.argmax(dim=1) == labels).sum().item()
93
+ topk = min(3, logits.size(1))
94
+ top3_correct += logits.topk(topk, dim=1).indices.eq(labels[:, None]).any(dim=1).sum().item()
95
+ total += batch_size
96
+ preds_all.append(logits.argmax(dim=1).detach().cpu().numpy())
97
+ labels_all.append(labels.detach().cpu().numpy())
98
+
99
+ y_pred = np.concatenate(preds_all) if preds_all else np.array([])
100
+ y_true = np.concatenate(labels_all) if labels_all else np.array([])
101
+
102
+ return {
103
+ "loss": total_loss / max(total, 1),
104
+ "accuracy": correct / max(total, 1),
105
+ "balanced_accuracy": float(balanced_accuracy_score(y_true, y_pred)) if total else 0.0,
106
+ "f1_macro": float(precision_recall_fscore_support(y_true, y_pred, average="macro", zero_division=0)[2]) if total else 0.0,
107
+ "top3_accuracy": top3_correct / max(total, 1),
108
+ }
109
+
110
+
111
+ def save_checkpoint(
112
+ path: Path,
113
+ model: DualEffB2MetadataClassifier,
114
+ optimizer: torch.optim.Optimizer,
115
+ epoch: int,
116
+ phase: str,
117
+ best_val_loss: float,
118
+ class_names: list[str],
119
+ label_to_idx: dict[str, int],
120
+ metadata_spec: dict[str, Any],
121
+ args: argparse.Namespace,
122
+ ) -> None:
123
+ torch.save(
124
+ {
125
+ "epoch": epoch,
126
+ "phase": phase,
127
+ "model_state": model.state_dict(),
128
+ "optimizer_state": optimizer.state_dict(),
129
+ "best_val_loss": best_val_loss,
130
+ "class_names": class_names,
131
+ "label_to_idx": label_to_idx,
132
+ "metadata_spec": metadata_spec,
133
+ "args": json_safe(vars(args)),
134
+ },
135
+ path,
136
+ )
137
+
138
+
139
+ def train_phase(
140
+ phase: str,
141
+ num_epochs: int,
142
+ start_epoch: int,
143
+ model: DualEffB2MetadataClassifier,
144
+ train_loader: DataLoader,
145
+ val_loader: DataLoader,
146
+ criterion: nn.Module,
147
+ device: torch.device,
148
+ args: argparse.Namespace,
149
+ class_names: list[str],
150
+ label_to_idx: dict[str, int],
151
+ metadata_spec: dict[str, Any],
152
+ output_dir: Path,
153
+ history: list[dict[str, Any]],
154
+ best_val_loss: float,
155
+ ) -> tuple[int, float]:
156
+ if num_epochs <= 0:
157
+ return start_epoch, best_val_loss
158
+
159
+ encoders_trainable = phase == "finetune"
160
+ set_encoder_trainable(model, encoders_trainable)
161
+ optimizer = build_optimizer(model, args, encoders_trainable)
162
+ scheduler = torch.optim.lr_scheduler.ReduceLROnPlateau(optimizer, mode="min", factor=0.2, patience=2)
163
+ scaler = GradScaler("cuda", enabled=args.amp and device.type == "cuda")
164
+ use_amp = args.amp and device.type == "cuda"
165
+ patience_count = 0
166
+
167
+ print(f"\nPhase: {phase}, epochs={num_epochs}, encoders_trainable={encoders_trainable}")
168
+ for local_epoch in range(1, num_epochs + 1):
169
+ epoch = start_epoch + local_epoch - 1
170
+ if hasattr(criterion, "set_epoch"):
171
+ criterion.set_epoch(epoch)
172
+ train_stats = run_epoch(model, train_loader, criterion, device, optimizer, scaler, use_amp)
173
+ val_stats = run_epoch(model, val_loader, criterion, device)
174
+ scheduler.step(val_stats["loss"])
175
+ row = {
176
+ "phase": phase,
177
+ "epoch": epoch,
178
+ **{f"train_{key}": value for key, value in train_stats.items()},
179
+ **{f"val_{key}": value for key, value in val_stats.items()},
180
+ }
181
+ history.append(row)
182
+ pd.DataFrame(history).to_csv(output_dir / "history.csv", index=False)
183
+ print(
184
+ f"{phase} epoch {epoch:03d}: "
185
+ f"train_loss={train_stats['loss']:.4f} val_loss={val_stats['loss']:.4f} "
186
+ f"train_bal_acc={train_stats['balanced_accuracy']:.4f} train_f1={train_stats['f1_macro']:.4f} "
187
+ f"val_acc={val_stats['accuracy']:.4f} val_bal_acc={val_stats['balanced_accuracy']:.4f} "
188
+ f"val_f1={val_stats['f1_macro']:.4f} val_top3={val_stats['top3_accuracy']:.4f}"
189
+ )
190
+
191
+ if val_stats["loss"] < best_val_loss:
192
+ best_val_loss = val_stats["loss"]
193
+ patience_count = 0
194
+ save_checkpoint(
195
+ output_dir / "best.pt",
196
+ model,
197
+ optimizer,
198
+ epoch,
199
+ phase,
200
+ best_val_loss,
201
+ class_names,
202
+ label_to_idx,
203
+ metadata_spec,
204
+ args,
205
+ )
206
+ else:
207
+ patience_count += 1
208
+ if patience_count >= args.patience:
209
+ print(f"Early stopping {phase} at epoch {epoch}")
210
+ break
211
+
212
+ return start_epoch + num_epochs, best_val_loss
213
+
214
+
215
+ def build_model(
216
+ class_names: list[str],
217
+ metadata_dim: int,
218
+ args: argparse.Namespace,
219
+ device: torch.device,
220
+ clinical_backbone_backend: str,
221
+ dermoscopic_backbone_backend: str,
222
+ ) -> DualEffB2MetadataClassifier:
223
+ model = DualEffB2MetadataClassifier(
224
+ num_classes=len(class_names),
225
+ metadata_input_dim=metadata_dim,
226
+ branch_dim=args.branch_dim,
227
+ metadata_dim=args.metadata_dim,
228
+ classifier_hidden_dim=args.classifier_hidden_dim,
229
+ dropout=args.dropout,
230
+ imagenet_pretrained=args.imagenet_pretrained,
231
+ clinical_backbone_backend=clinical_backbone_backend,
232
+ dermoscopic_backbone_backend=dermoscopic_backbone_backend,
233
+ ).to(device)
234
+ load_encoder_checkpoint(args.clinical_checkpoint, model.clinical_encoder, "clinical", device)
235
+ load_encoder_checkpoint(args.dermoscopic_checkpoint, model.dermoscopic_encoder, "dermoscopic", device)
236
+ return model
237
+
238
+
239
+ def save_run_config(
240
+ output_dir: Path,
241
+ args: argparse.Namespace,
242
+ class_names: list[str],
243
+ metadata_spec: dict[str, Any],
244
+ train_df: pd.DataFrame,
245
+ val_df: pd.DataFrame,
246
+ clinical_backbone_backend: str,
247
+ dermoscopic_backbone_backend: str,
248
+ fold: int | None = None,
249
+ ) -> None:
250
+ payload = {
251
+ "args": json_safe(vars(args)),
252
+ "class_names": class_names,
253
+ "metadata_spec": json_safe(metadata_spec),
254
+ "train_size": len(train_df),
255
+ "val_size": len(val_df),
256
+ "fold": fold,
257
+ "fusion": "concat(clinical_head, dermoscopic_head, metadata_head)",
258
+ "clinical_backbone": f"{clinical_backbone_backend} efficientnet_b2",
259
+ "dermoscopic_backbone": f"{dermoscopic_backbone_backend} efficientnet_b2",
260
+ }
261
+ with open(output_dir / "run_config.json", "w", encoding="utf-8") as f:
262
+ json.dump(payload, f, indent=2)
263
+
264
+
265
+ def run_training_split(
266
+ df: pd.DataFrame,
267
+ train_df: pd.DataFrame,
268
+ val_df: pd.DataFrame,
269
+ class_names: list[str],
270
+ label_to_idx: dict[str, int],
271
+ args: argparse.Namespace,
272
+ device: torch.device,
273
+ clinical_backbone_backend: str,
274
+ dermoscopic_backbone_backend: str,
275
+ output_dir: Path,
276
+ fold: int | None = None,
277
+ ) -> dict[str, Any]:
278
+ output_dir.mkdir(parents=True, exist_ok=True)
279
+ split_dir = output_dir / "splits"
280
+ split_dir.mkdir(exist_ok=True)
281
+ train_df.to_csv(split_dir / "train.csv", index=False)
282
+ val_df.to_csv(split_dir / "val.csv", index=False)
283
+
284
+ metadata_spec = fit_metadata_spec(train_df)
285
+ metadata_dim = len(metadata_vector(train_df.iloc[0], metadata_spec))
286
+ save_run_config(
287
+ output_dir,
288
+ args,
289
+ class_names,
290
+ metadata_spec,
291
+ train_df,
292
+ val_df,
293
+ clinical_backbone_backend,
294
+ dermoscopic_backbone_backend,
295
+ fold,
296
+ )
297
+
298
+ model = build_model(
299
+ class_names,
300
+ metadata_dim,
301
+ args,
302
+ device,
303
+ clinical_backbone_backend,
304
+ dermoscopic_backbone_backend,
305
+ )
306
+ train_loader, val_loader = make_loaders(train_df, val_df, label_to_idx, metadata_spec, args)
307
+ criterion = build_loss(train_df, label_to_idx, args, device)
308
+
309
+ print(f"Output dir: {output_dir}")
310
+ print(f"Device: {device}")
311
+ print(f"Classes: {class_names}")
312
+ print(f"Paired lesions: train={len(train_df)}, val={len(val_df)}, total={len(df)}")
313
+ print(f"Metadata input dim: {metadata_dim}")
314
+ print(f"MONET columns: {len(metadata_spec.get('monet_columns', []))}")
315
+ print(f"Loss: {args.loss}, class_weight={args.class_weight}, weighted_sampler={args.weighted_sampler}")
316
+ if args.loss == "milk_lt" and args.class_weight:
317
+ print("Note: --class-weight is ignored for --loss milk_lt because milk_lt uses effective-number alpha.")
318
+
319
+ history: list[dict[str, Any]] = []
320
+ epoch, best_val_loss = train_phase(
321
+ "freeze",
322
+ args.freeze_epochs,
323
+ 1,
324
+ model,
325
+ train_loader,
326
+ val_loader,
327
+ criterion,
328
+ device,
329
+ args,
330
+ class_names,
331
+ label_to_idx,
332
+ metadata_spec,
333
+ output_dir,
334
+ history,
335
+ float("inf"),
336
+ )
337
+ epoch, best_val_loss = train_phase(
338
+ "finetune",
339
+ args.finetune_epochs,
340
+ epoch,
341
+ model,
342
+ train_loader,
343
+ val_loader,
344
+ criterion,
345
+ device,
346
+ args,
347
+ class_names,
348
+ label_to_idx,
349
+ metadata_spec,
350
+ output_dir,
351
+ history,
352
+ best_val_loss,
353
+ )
354
+
355
+ best_path = output_dir / "best.pt"
356
+ if best_path.exists():
357
+ checkpoint = torch.load(best_path, map_location=device, weights_only=False)
358
+ model.load_state_dict(checkpoint["model_state"])
359
+ y_true, y_prob = predict(model, val_loader, device)
360
+ metrics, per_class_df, cm = compute_metrics(y_true, y_prob, class_names)
361
+ metrics = {"best_val_loss": float(best_val_loss), **metrics}
362
+ with open(output_dir / "metrics.json", "w", encoding="utf-8") as f:
363
+ json.dump(json_safe(metrics), f, indent=2)
364
+ pd.DataFrame(cm, index=class_names, columns=class_names).to_csv(output_dir / "confusion_matrix.csv")
365
+ per_class_df.to_csv(output_dir / "per_class_metrics.csv", index=False)
366
+ save_predictions(val_df, y_true, y_prob, class_names, output_dir)
367
+ print(
368
+ f"Done: best_val_loss={best_val_loss:.4f}, "
369
+ f"val_acc={metrics['accuracy']:.4f}, balanced_acc={metrics['balanced_accuracy']:.4f}, "
370
+ f"f1_macro={metrics['f1_macro']:.4f}, top3={metrics['top3_accuracy']:.4f}, "
371
+ f"auc_macro={metrics['roc_auc_macro_ovr']}"
372
+ )
373
+ return metrics
374
+
375
+
376
+ def train_single_run(
377
+ df: pd.DataFrame,
378
+ class_names: list[str],
379
+ label_to_idx: dict[str, int],
380
+ args: argparse.Namespace,
381
+ device: torch.device,
382
+ clinical_backbone_backend: str,
383
+ dermoscopic_backbone_backend: str,
384
+ ) -> dict[str, Any]:
385
+ train_df, val_df = lesion_split(df, args.val_size, args.seed)
386
+ return run_training_split(
387
+ df,
388
+ train_df,
389
+ val_df,
390
+ class_names,
391
+ label_to_idx,
392
+ args,
393
+ device,
394
+ clinical_backbone_backend,
395
+ dermoscopic_backbone_backend,
396
+ args.output_dir,
397
+ )
398
+
399
+
400
+ def train_kfold(
401
+ df: pd.DataFrame,
402
+ class_names: list[str],
403
+ label_to_idx: dict[str, int],
404
+ args: argparse.Namespace,
405
+ device: torch.device,
406
+ clinical_backbone_backend: str,
407
+ dermoscopic_backbone_backend: str,
408
+ ) -> list[dict[str, Any]]:
409
+ fold_metrics = []
410
+ for fold_idx, (train_df, val_df) in enumerate(kfold_splits(df, args.k_folds, args.seed)):
411
+ print(f"\nK-fold {fold_idx + 1}/{args.k_folds}")
412
+ metrics = run_training_split(
413
+ df,
414
+ train_df,
415
+ val_df,
416
+ class_names,
417
+ label_to_idx,
418
+ args,
419
+ device,
420
+ clinical_backbone_backend,
421
+ dermoscopic_backbone_backend,
422
+ args.output_dir / f"fold_{fold_idx:02d}",
423
+ fold_idx,
424
+ )
425
+ fold_metrics.append({"fold": fold_idx, **metrics})
426
+ save_kfold_summary(fold_metrics, args.output_dir)
427
+ return fold_metrics
428
+
429
+
430
+ def save_kfold_summary(fold_metrics: list[dict[str, Any]], output_dir: Path) -> None:
431
+ summary_keys = [
432
+ "best_val_loss",
433
+ "accuracy",
434
+ "balanced_accuracy",
435
+ "f1_macro",
436
+ "roc_auc_macro_ovr",
437
+ "top3_accuracy",
438
+ ]
439
+ rows = []
440
+ for metrics in fold_metrics:
441
+ rows.append({key: metrics.get(key) for key in ["fold", *summary_keys]})
442
+ summary_df = pd.DataFrame(rows)
443
+ summary_df.to_csv(output_dir / "kfold_summary.csv", index=False)
444
+
445
+ aggregate: dict[str, Any] = {"folds": json_safe(rows), "mean": {}, "std": {}}
446
+ for key in summary_keys:
447
+ values = pd.to_numeric(summary_df[key], errors="coerce").dropna()
448
+ aggregate["mean"][key] = None if values.empty else float(values.mean())
449
+ aggregate["std"][key] = None if values.empty else float(values.std(ddof=0))
450
+ with open(output_dir / "kfold_summary.json", "w", encoding="utf-8") as f:
451
+ json.dump(aggregate, f, indent=2)
452
+
453
+
454
+ def json_safe(value):
455
+ if isinstance(value, Path):
456
+ return str(value)
457
+ if isinstance(value, dict):
458
+ return {key: json_safe(item) for key, item in value.items()}
459
+ if isinstance(value, (list, tuple)):
460
+ return [json_safe(item) for item in value]
461
+ if isinstance(value, np.ndarray):
462
+ return value.tolist()
463
+ if isinstance(value, np.generic):
464
+ return value.item()
465
+ return value
466
+
467
+
468
+ def run(args: argparse.Namespace) -> None:
469
+ if args.k_folds < 1:
470
+ raise ValueError("--k-folds must be at least 1.")
471
+
472
+ set_seed(args.seed)
473
+ data_dir = resolve_data_dir(args.data_dir)
474
+ args.output_dir.mkdir(parents=True, exist_ok=True)
475
+
476
+ df = load_paired_dataframe(data_dir)
477
+ class_names = sorted(df["label"].unique())
478
+ label_to_idx = {label: idx for idx, label in enumerate(class_names)}
479
+ device = torch.device("cuda" if torch.cuda.is_available() else "cpu")
480
+ clinical_backbone_backend, dermoscopic_backbone_backend = resolve_backbone_backends(args, device)
481
+
482
+ print(f"Data dir: {data_dir}")
483
+ if args.k_folds == 1:
484
+ train_single_run(
485
+ df,
486
+ class_names,
487
+ label_to_idx,
488
+ args,
489
+ device,
490
+ clinical_backbone_backend,
491
+ dermoscopic_backbone_backend,
492
+ )
493
+ else:
494
+ train_kfold(
495
+ df,
496
+ class_names,
497
+ label_to_idx,
498
+ args,
499
+ device,
500
+ clinical_backbone_backend,
501
+ dermoscopic_backbone_backend,
502
+ )