diff --git a/README_windows_friendly_format.md b/README_windows_friendly_format.md new file mode 100644 index 0000000000000000000000000000000000000000..3e86bfb64c8cc95b2d33905cbd47c09bec0ea18e --- /dev/null +++ b/README_windows_friendly_format.md @@ -0,0 +1,36 @@ +# Windows-Friendly Prepared Dataset + +This dataset root is generated from the original `new_data` and keeps the old dataset untouched. + +## Goals + +- reduce file-count and random gzip/json parsing on Windows +- keep split data already laid out by split +- keep samples in source shard order so later training can stream sequentially +- avoid requiring the old `*_refs.npz` indirection during later training + +## Layout + +- `manifest.json`: top-level dataset manifest for the new format +- `source_manifest.original.json`: copied manifest from the original dataset +- `grids.json`, `materials_catalog.json`, `merged_stats.json`, `dedup_stats.json` +- `windows_seq//manifest.json` +- `windows_seq//chunk_xxxxxx_target_field.npy` +- `windows_seq//chunk_xxxxxx_meta.npz` + +## Chunk schema + +- `chunk_*_target_field.npy` + - dtype: `uint16` + - shape: `[N, 774]` + - decode later with `float32 = uint16 * 0.001` +- `chunk_*_meta.npz` + - fixed-size arrays for sample id, constraints, and structure labels + - variable-length sequences are padded to `max_layers=24` + +## Build config + +- selected_splits: train, val, test +- chunk_size: 32768 +- sample_order: source_shard_order +- recommended later train order: sequential, no extra shuffle diff --git "a/README_\346\227\247\347\211\210\346\240\274\345\274\217\345\217\202\350\200\203.md" "b/README_\346\227\247\347\211\210\346\240\274\345\274\217\345\217\202\350\200\203.md" new file mode 100644 index 0000000000000000000000000000000000000000..eceb3eda24497eebbf042bf2a9c60f09d2ac8906 --- /dev/null +++ "b/README_\346\227\247\347\211\210\346\240\274\345\274\217\345\217\202\350\200\203.md" @@ -0,0 +1,352 @@ +# Prepared Training Dataset 使用说明 + +本目录是已经整理好的统一训练数据集视图,不再是母本生成目录。 + +公开仓库建议: +- 保留本说明文档和必要的数据协议说明 +- 不直接提交 `shards/`、`splits/`、大体量 `npz/jsonl.gz` 数据文件 +- 通过环境变量或本地路径在私有环境中挂载真实数据 + +目标: +- 直接作为后续主模型训练输入 +- 不再重复做多源合并、跨目录去重、目标场拼接 +- 读取时动态采样条件模式 + +## 1. 目录结构 + +本目录下的主要文件: + +- `manifest.json` + - 数据集总说明 + - 记录输出根目录、源目录、split 比例、target field 顺序等 +- `grids.json` + - 固定波长网格 + - target field 的全局布局定义 +- `materials_catalog.json` + - 14 种材料、角色映射、substrate 选项 +- `merged_stats.json` + - 合并整理后的整体统计 +- `dedup_stats.json` + - 跨目录去重统计 +- `shards/` + - `shard_xxxxxx.jsonl.gz` + - 每条样本的结构标签、来源、约束、target field 引用 + - `shard_xxxxxx_target_field.npz` + - 每条样本拼接后的统一目标场,存储格式 `uint16_x1000` + - `shard_xxxxxx_index.npz` + - 轻量索引,用于快速生成 split ref +- `splits/` + - `train_ids.txt / val_ids.txt / test_ids.txt` + - `hard_test_ids.txt / ood_test_ids.txt` + - `train_refs.npz / val_refs.npz / test_refs.npz` + - 推荐训练时直接用 `*_refs.npz` + +## 2. Split 比例 + +当前整理后的正式 split 比例是: + +- `train = 80%` +- `test = 15%` +- `val = 5%` + +额外还有: + +- `hard_test` +- `ood_test` + +这两个不是从 `test` 中扣除,而是额外评估视图。 + +## 3. 统一 target field 协议 + +每条样本的目标场已经被统一拼接成一个一维序列: + +1. `visible R` +2. `visible T` +3. `nir R` +4. `nir T` +5. `ir E_normal` + +固定长度: + +- `vis_R`: 101 +- `vis_T`: 101 +- `nir_R`: 173 +- `nir_T`: 173 +- `ir_E_normal`: 226 +- 合计:`774` + +因此: + +- `target_field.shape = [774]` + +数值存储: + +- 磁盘上:`uint16_x1000` +- 读取后:`float32`,范围 `0~1` + +## 4. 读取时返回什么 + +建议统一通过: + +- `coolhouse3_diffusion/new_dataset_maker/dataset.py` + +中的: + +- `PreparedTrainingDataset` + +读取。 + +### 单条样本返回字段 + +`PreparedTrainingDataset[idx]` 返回: + +- `sample_id` +- `target_field` +- `condition_mask` +- `objective_weights` +- `window_ids` +- `channel_ids` +- `position_ids` +- `constraint_field` +- `structure_labels` +- `condition_mode` + +其中: + +- `target_field` + - `float32[774]` +- `condition_mask` + - `float32[774]` + - 1 表示该位置作为已知条件输入 +- `objective_weights` + - `float32[774]` + - 默认与 `condition_mask` 同步 +- `window_ids / channel_ids / position_ids` + - token 级辅助编码字段 +- `constraint_field` + - 全局约束信息 +- `structure_labels` + - 监督标签 + +## 5. 条件模式怎么用 + +读取时不需要把一个母本样本提前展开成很多份。 + +正确用法是: +- 一个样本只存一份完整 `target_field` +- 训练时动态采样 condition mode +- 再生成 `condition_mask` 和 `objective_weights` + +当前支持: + +- `full_condition` +- `vis_only` +- `nir_only` +- `ir_only` +- `vis_nir` +- `vis_ir` +- `nir_ir` +- `custom_channel_subset` +- `random` + +推荐: + +- 训练阶段:`condition_mode="random"` +- 验证阶段:固定几种模式分别跑 +- 测试阶段:按任务定义固定模式 + +## 6. constraint_field 的用法 + +`constraint_field` 是全局条件,不是 token 级光谱。 + +读取后至少包含: + +- `allowed_material_mask` +- `allowed_layer_count_mask` +- `allow_top_metal` +- `allow_bottom_metal` +- `max_metal_layers` +- `substrate_id` +- `prototype_family_hint` + +说明: + +- 即使磁盘中是 compact 版本,`dataset.py` 读取时也会自动补齐默认约束 +- 所以后续训练代码统一按完整字段使用即可 + +## 7. structure_labels 的用法 + +`structure_labels` 里包含: + +- `layer_count` +- `material_sequence_ids` +- `material_role_sequence_ids` +- `coarse_thickness_bin_ids` +- `continuous_thickness_values` + +建议训练用途: + +- 离散结构生成器 + - 用 `material_sequence_ids` + - 用 `coarse_thickness_bin_ids` +- 连续厚度回归/微调头 + - 用 `continuous_thickness_values` +- 长度监督 + - 用 `layer_count` + +注意: + +- `material_sequence_ids` 和厚度序列是变长的 +- DataLoader 通常需要自定义 `collate_fn` 做 padding + +## 8. 条件场编码器怎么接 + +建议用: + +- `coolhouse3_diffusion/new_dataset_maker/encoder.py` + +中的: + +- `ConditionFieldEncoder` + +输入: + +- `target_field` +- `condition_mask` +- `objective_weights` +- `window_ids` +- `channel_ids` +- `position_ids` +- `constraint_field` + +输出: + +- `condition_tokens` +- `global_condition_embedding` + +推荐接法: + +- `condition_tokens` + - 给 token 级结构生成器做 cross-attention 或 concat conditioning +- `global_condition_embedding` + - 给长度头、全局先验头、或者 decoder 初始态使用 + +## 9. 最小读取示例 + +```python +from torch.utils.data import DataLoader + +from new_dataset_maker.dataset import PreparedTrainingDataset + +train_ds = PreparedTrainingDataset( + dataset_root="./new_data", + split="train", + condition_mode="random", +) + +sample = train_ds[0] +print(sample["target_field"].shape) # (774,) +print(sample["condition_mask"].shape) # (774,) +print(sample["objective_weights"].shape) # (774,) +print(sample["structure_labels"]["layer_count"]) + +loader = DataLoader( + train_ds, + batch_size=16, + shuffle=True, + num_workers=4, +) +``` + +## 10. 最小 encoder 接入示例 + +```python +import torch + +from new_dataset_maker.dataset import PreparedTrainingDataset +from new_dataset_maker.encoder import ConditionFieldEncoder + +ds = PreparedTrainingDataset( + dataset_root="./new_data", + split="train", + condition_mode="vis_ir", +) + +sample = ds[0] + +encoder = ConditionFieldEncoder( + target_length=sample["target_field"].shape[0], + num_window_ids=int(sample["window_ids"].max()) + 1, + num_channel_ids=int(sample["channel_ids"].max()) + 1, + num_position_ids=int(sample["position_ids"].max()) + 1, + num_materials=sample["constraint_field"]["allowed_material_mask"].shape[0], + num_layer_count_ids=sample["constraint_field"]["allowed_layer_count_mask"].shape[0], + num_substrates=2, + num_prototypes=8, +) + +batch = { + "target_field": torch.from_numpy(sample["target_field"]).unsqueeze(0), + "condition_mask": torch.from_numpy(sample["condition_mask"]).unsqueeze(0), + "objective_weights": torch.from_numpy(sample["objective_weights"]).unsqueeze(0), + "window_ids": torch.from_numpy(sample["window_ids"]).unsqueeze(0), + "channel_ids": torch.from_numpy(sample["channel_ids"]).unsqueeze(0), + "position_ids": torch.from_numpy(sample["position_ids"]).unsqueeze(0), + "constraint_field": { + "allowed_material_mask": torch.from_numpy(sample["constraint_field"]["allowed_material_mask"]).unsqueeze(0), + "allowed_layer_count_mask": torch.from_numpy(sample["constraint_field"]["allowed_layer_count_mask"]).unsqueeze(0), + "allow_top_metal": torch.tensor([[sample["constraint_field"]["allow_top_metal"]]], dtype=torch.float32), + "allow_bottom_metal": torch.tensor([[sample["constraint_field"]["allow_bottom_metal"]]], dtype=torch.float32), + "max_metal_layers": torch.tensor([[sample["constraint_field"]["max_metal_layers"]]], dtype=torch.float32), + "substrate_id": torch.tensor([sample["constraint_field"]["substrate_id"]], dtype=torch.long), + "prototype_family_hint": torch.tensor([sample["constraint_field"]["prototype_family_hint"]], dtype=torch.long), + }, +} + +condition_tokens, global_condition_embedding = encoder(**batch) +print(condition_tokens.shape) +print(global_condition_embedding.shape) +``` + +## 11. 后续主模型训练建议 + +推荐把训练链路分成这几层: + +1. `PreparedTrainingDataset` + - 负责读取整理后的统一样本协议 + - 动态采样 condition mode + +2. `collate_fn` + - 负责对变长 `material_sequence_ids / thickness` 做 padding + +3. `ConditionFieldEncoder` + - 负责把目标光谱条件和全局约束编码成统一条件表示 + +4. 主生成器 + - 读取 `condition_tokens + global_condition_embedding` + - 预测 `layer_count / material_sequence / thickness` + +## 12. 不建议的用法 + +不要这样做: + +- 不要直接手写解析 `jsonl.gz + npz` +- 不要把 `condition_mask` 只放到 loss 里而不编码 +- 不要把固定网格重复写进每条样本 +- 不要预先把一个样本展开成多份条件模板写回磁盘 + +正确做法是: + +- 训练时动态采样条件模式 +- 统一通过 `dataset.py` 读取 +- 统一通过 `encoder.py` 做条件编码 + +## 13. 当前 compact 版本说明 + +为了节省空间,当前 prepared dataset 采用 compact 记录格式: + +- 元数据:`jsonl.gz` +- target field:`npz(uint16_x1000)` +- 固定约束:读取时动态补全 + +所以看到某些字段没有完整重复存储是正常的,不影响训练。 diff --git a/dedup_stats.json b/dedup_stats.json new file mode 100644 index 0000000000000000000000000000000000000000..453a6b9e79bcea5b678fb955695e71a474b7a1d0 --- /dev/null +++ b/dedup_stats.json @@ -0,0 +1,14 @@ +{ + "dedup_enabled": true, + "signature_tolerance_nm": 1.0, + "unique_count": 19831633, + "duplicate_count": 228367, + "source_duplicate_counts": { + "src_00_generated_dataset_full": 0, + "src_01_generated_dataset_full_2": 2017, + "src_02_generated_dataset_full_1": 5113, + "src_03_generated_dataset_full_2": 7860, + "src_04_generated_dataset_full_3": 13377, + "src_05_generated_dataset_full_4": 200000 + } +} \ No newline at end of file diff --git a/grids.json b/grids.json new file mode 100644 index 0000000000000000000000000000000000000000..7fb01605939070d5b404281cefe931986d6d7823 --- /dev/null +++ b/grids.json @@ -0,0 +1,3827 @@ +{ + "vis_nm": [ + 380.0, + 384.0, + 388.0, + 392.0, + 396.0, + 400.0, + 404.0, + 408.0, + 412.0, + 416.0, + 420.0, + 424.0, + 428.0, + 432.0, + 436.0, + 440.0, + 444.0, + 448.0, + 452.0, + 456.0, + 460.0, + 464.0, + 468.0, + 472.0, + 476.0, + 480.0, + 484.0, + 488.0, + 492.0, + 496.0, + 500.0, + 504.0, + 508.0, + 512.0, + 516.0, + 520.0, + 524.0, + 528.0, + 532.0, + 536.0, + 540.0, + 544.0, + 548.0, + 552.0, + 556.0, + 560.0, + 564.0, + 568.0, + 572.0, + 576.0, + 580.0, + 584.0, + 588.0, + 592.0, + 596.0, + 600.0, + 604.0, + 608.0, + 612.0, + 616.0, + 620.0, + 624.0, + 628.0, + 632.0, + 636.0, + 640.0, + 644.0, + 648.0, + 652.0, + 656.0, + 660.0, + 664.0, + 668.0, + 672.0, + 676.0, + 680.0, + 684.0, + 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