A Scalable Deep Learning Framework for Wave-Based Inverse Problems
Project description
A Scalable Deep Learning Framework for Wave-Based Inverse Problems
Production-ready • Multi-GPU DDP • Memory-Efficient • Plug-and-Play
Getting Started • Documentation • Examples • Discussions • Citation
Plug in your model, load your data, and let WaveDL do the heavy lifting 💪
💡 What is WaveDL?
WaveDL is a deep learning framework built for wave-based inverse problems — from ultrasonic NDE and geophysics to biomedical tissue characterization. It provides a robust, scalable training pipeline for mapping multi-dimensional data (1D/2D/3D) to physical quantities.
Input: Waveforms, spectrograms, B-scans, dispersion curves, ...
↓
Output: Material properties, defect dimensions, damage locations, ...
The framework handles the engineering challenges of large-scale deep learning — big datasets, distributed training, and HPC deployment — so you can focus on the science, not the infrastructure.
Built for researchers who need:
- 📊 Multi-target regression with reproducibility and fair benchmarking
- 🚀 Seamless multi-GPU training on HPC clusters
- 💾 Memory-efficient handling of large-scale datasets
- 🔧 Easy integration of custom model architectures
✨ Features
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⚡ Load All Data — No More Bottleneck Train on datasets larger than RAM:
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🧠 One-Line Model Registration Plug in any architecture: @register_model("my_net")
class MyNet(BaseModel): ...
Design your model. Register with one line. |
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🛡️ DDP That Actually Works Multi-GPU training without the pain:
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📊 Publish-Ready Output Results go straight to your paper:
|
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🖥️ HPC-Native Design Built for high-performance clusters:
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🔄 Crash-Proof Training Never lose your progress:
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🎛️ Flexible & Reproducible Training Fully configurable via CLI flags or YAML:
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📦 ONNX Export Deploy models anywhere:
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🚀 Getting Started
Installation
From PyPI (recommended for all users)
pip install wavedl
This installs everything you need: training, inference, HPO, ONNX export, and dev tools.
From Source (for development)
git clone https://github.com/ductho-le/WaveDL.git
cd WaveDL
pip install -e .
[!NOTE] Python 3.11+ required. For development setup, see CONTRIBUTING.md.
Quick Start
[!TIP] In all examples below, replace
<...>placeholders with your values. See Configuration for defaults and options.
Option 1: Using wavedl-hpc (Recommended for HPC)
The wavedl-hpc command automatically configures the environment for HPC systems:
# Basic training (auto-detects available GPUs)
wavedl-hpc --model <model_name> --data_path <train_data> --batch_size <number> --output_dir <output_folder>
# Detailed configuration
wavedl-hpc --model <model_name> --data_path <train_data> --batch_size <number> \
--lr <number> --epochs <number> --patience <number> --compile --output_dir <output_folder>
# Specify GPU count explicitly
wavedl-hpc --num_gpus 4 --model cnn --data_path train.npz --output_dir results
Option 2: Direct Accelerate Launch
# Local - auto-detects GPUs
accelerate launch -m wavedl.train --model <model_name> --data_path <train_data> --batch_size <number> --output_dir <output_folder>
# Resume training (automatic - just re-run with same output_dir)
# Manual resume from specific checkpoint:
accelerate launch -m wavedl.train --model <model_name> --data_path <train_data> --resume <checkpoint_folder> --output_dir <output_folder>
# Force fresh start (ignores existing checkpoints)
accelerate launch -m wavedl.train --model <model_name> --data_path <train_data> --output_dir <output_folder> --fresh
# List available models
wavedl-train --list_models
[!TIP] Auto-Resume: If training crashes or is interrupted, simply re-run with the same
--output_dir. The framework automatically detects incomplete training and resumes from the last checkpoint. Use--freshto force a fresh start.GPU Auto-Detection:
wavedl-hpcautomatically detects available GPUs usingnvidia-smi. Use--num_gpusto override.
Testing & Inference
After training, use wavedl.test to evaluate your model on test data:
# Basic inference
python -m wavedl.test --checkpoint <checkpoint_folder> --data_path <test_data>
# With visualization, CSV export, and multiple file formats
python -m wavedl.test --checkpoint <checkpoint_folder> --data_path <test_data> \
--plot --plot_format png pdf --save_predictions --output_dir <output_folder>
# With custom parameter names
python -m wavedl.test --checkpoint <checkpoint_folder> --data_path <test_data> \
--param_names '$p_1$' '$p_2$' '$p_3$' --plot
# Export model to ONNX for deployment (LabVIEW, MATLAB, C++, etc.)
python -m wavedl.test --checkpoint <checkpoint_folder> --data_path <test_data> \
--export onnx --export_path <output_file.onnx>
Output:
- Console: R², Pearson correlation, MAE per parameter
- CSV (with
--save_predictions): True, predicted, error, and absolute error for all parameters - Plots (with
--plot): 10 publication-quality plots (scatter, histogram, residuals, Bland-Altman, Q-Q, correlation, relative error, CDF, index plot, box plot) - Format (with
--plot_format): Supported formats:png(default),pdf(vector),svg(vector),eps(LaTeX),tiff,jpg,ps
[!NOTE]
wavedl.testauto-detects the model architecture from checkpoint metadata. If unavailable, it falls back to folder name parsing. Use--modelto override if needed.
Adding Custom Models
Creating Your Own Architecture
Requirements (your model must):
- Inherit from
BaseModel - Accept
in_channels,num_outputs,input_shapein__init__ - Return a tensor of shape
(batch, num_outputs)fromforward()
Step 1: Create my_model.py
import torch.nn as nn
import torch.nn.functional as F
from wavedl.models import BaseModel, register_model
@register_model("my_model") # This name is used with --model flag
class MyModel(BaseModel):
def __init__(self, in_channels, num_outputs, input_shape):
# in_channels: number of input channels (auto-detected from data)
# num_outputs: number of parameters to predict (auto-detected from data)
# input_shape: spatial dimensions, e.g., (128,) or (64, 64) or (32, 32, 32)
super().__init__(in_channels, num_outputs, input_shape)
# Define your layers (this is just an example)
self.conv1 = nn.Conv2d(in_channels, 64, 3, padding=1)
self.conv2 = nn.Conv2d(64, 128, 3, padding=1)
self.fc = nn.Linear(128, num_outputs)
def forward(self, x):
# Input x has shape: (batch, in_channels, *input_shape)
x = F.relu(self.conv1(x))
x = F.relu(self.conv2(x))
x = x.mean(dim=[-2, -1]) # Global average pooling
return self.fc(x) # Output shape: (batch, num_outputs)
Step 2: Train
wavedl-hpc --import my_model --model my_model --data_path train.npz
WaveDL handles everything else: training loop, logging, checkpoints, multi-GPU, early stopping, etc.
📁 Project Structure
WaveDL/
├── src/
│ └── wavedl/ # Main package (namespaced)
│ ├── __init__.py # Package init with __version__
│ ├── train.py # Training entry point
│ ├── test.py # Testing & inference script
│ ├── hpo.py # Hyperparameter optimization
│ ├── hpc.py # HPC distributed training launcher
│ │
│ ├── models/ # Model architectures (38 variants)
│ │ ├── registry.py # Model factory (@register_model)
│ │ ├── base.py # Abstract base class
│ │ ├── cnn.py # Baseline CNN (1D/2D/3D)
│ │ ├── resnet.py # ResNet-18/34/50 (1D/2D/3D)
│ │ ├── resnet3d.py # ResNet3D-18, MC3-18 (3D only)
│ │ ├── tcn.py # TCN (1D only)
│ │ ├── efficientnet.py # EfficientNet-B0/B1/B2 (2D)
│ │ ├── efficientnetv2.py # EfficientNetV2-S/M/L (2D)
│ │ ├── mobilenetv3.py # MobileNetV3-Small/Large (2D)
│ │ ├── regnet.py # RegNetY variants (2D)
│ │ ├── swin.py # Swin Transformer (2D)
│ │ ├── vit.py # Vision Transformer (1D/2D)
│ │ ├── convnext.py # ConvNeXt (1D/2D/3D)
│ │ ├── densenet.py # DenseNet-121/169 (1D/2D/3D)
│ │ └── unet.py # U-Net Regression
│ │
│ └── utils/ # Utilities
│ ├── data.py # Memory-mapped data pipeline
│ ├── metrics.py # R², Pearson, visualization
│ ├── distributed.py # DDP synchronization
│ ├── losses.py # Loss function factory
│ ├── optimizers.py # Optimizer factory
│ ├── schedulers.py # LR scheduler factory
│ └── config.py # YAML configuration support
│
├── configs/ # YAML config templates
├── examples/ # Ready-to-run examples
├── notebooks/ # Jupyter notebooks
├── unit_tests/ # Pytest test suite (704 tests)
│
├── pyproject.toml # Package config, dependencies
├── CHANGELOG.md # Version history
└── CITATION.cff # Citation metadata
⚙️ Configuration
[!NOTE] All configuration options below work with both
wavedl-hpcand directaccelerate launch. The wrapper script passes all arguments directly totrain.py.Examples:
# Using wavedl-hpc wavedl-hpc --model cnn --batch_size 256 --lr 5e-4 --compile # Using accelerate launch directly accelerate launch -m wavedl.train --model cnn --batch_size 256 --lr 5e-4 --compile
Available Models — 38 architectures
| Model | Params | Dim |
|---|---|---|
| CNN — Convolutional Neural Network | ||
cnn |
1.7M | 1D/2D/3D |
| ResNet — Residual Network | ||
resnet18 |
11.4M | 1D/2D/3D |
resnet34 |
21.5M | 1D/2D/3D |
resnet50 |
24.6M | 1D/2D/3D |
resnet18_pretrained ⭐ |
11.4M | 2D |
resnet50_pretrained ⭐ |
24.6M | 2D |
| ResNet3D — 3D Residual Network | ||
resnet3d_18 |
33.6M | 3D |
mc3_18 — Mixed Convolution 3D |
11.9M | 3D |
| TCN — Temporal Convolutional Network | ||
tcn_small |
1.0M | 1D |
tcn |
7.0M | 1D |
tcn_large |
10.2M | 1D |
| EfficientNet — Efficient Neural Network | ||
efficientnet_b0 ⭐ |
4.7M | 2D |
efficientnet_b1 ⭐ |
7.2M | 2D |
efficientnet_b2 ⭐ |
8.4M | 2D |
| EfficientNetV2 — Efficient Neural Network V2 | ||
efficientnet_v2_s ⭐ |
21.0M | 2D |
efficientnet_v2_m ⭐ |
53.6M | 2D |
efficientnet_v2_l ⭐ |
118.0M | 2D |
| MobileNetV3 — Mobile Neural Network V3 | ||
mobilenet_v3_small ⭐ |
1.1M | 2D |
mobilenet_v3_large ⭐ |
3.2M | 2D |
| RegNet — Regularized Network | ||
regnet_y_400mf ⭐ |
4.0M | 2D |
regnet_y_800mf ⭐ |
5.8M | 2D |
regnet_y_1_6gf ⭐ |
10.5M | 2D |
regnet_y_3_2gf ⭐ |
18.3M | 2D |
regnet_y_8gf ⭐ |
37.9M | 2D |
| Swin — Shifted Window Transformer | ||
swin_t ⭐ |
28.0M | 2D |
swin_s ⭐ |
49.4M | 2D |
swin_b ⭐ |
87.4M | 2D |
| ConvNeXt — Convolutional Next | ||
convnext_tiny |
28.2M | 1D/2D/3D |
convnext_small |
49.8M | 1D/2D/3D |
convnext_base |
88.1M | 1D/2D/3D |
convnext_tiny_pretrained ⭐ |
28.2M | 2D |
| DenseNet — Densely Connected Network | ||
densenet121 |
7.5M | 1D/2D/3D |
densenet169 |
13.3M | 1D/2D/3D |
densenet121_pretrained ⭐ |
7.5M | 2D |
| ViT — Vision Transformer | ||
vit_tiny |
5.5M | 1D/2D |
vit_small |
21.6M | 1D/2D |
vit_base |
85.6M | 1D/2D |
| U-Net — U-shaped Network | ||
unet_regression |
31.1M | 1D/2D/3D |
⭐ = Pretrained on ImageNet. Recommended for smaller datasets.
Training Parameters
| Argument | Default | Description |
|---|---|---|
--model |
cnn |
Model architecture |
--import |
- | Python modules to import (for custom models) |
--batch_size |
128 |
Per-GPU batch size |
--lr |
1e-3 |
Learning rate |
--epochs |
1000 |
Maximum epochs |
--patience |
20 |
Early stopping patience |
--weight_decay |
1e-4 |
AdamW regularization |
--grad_clip |
1.0 |
Gradient clipping |
Data & I/O
| Argument | Default | Description |
|---|---|---|
--data_path |
train_data.npz |
Dataset path |
--workers |
-1 |
DataLoader workers per GPU (-1=auto-detect) |
--seed |
2025 |
Random seed |
--output_dir |
. |
Output directory for checkpoints |
--resume |
None |
Checkpoint to resume (auto-detected if not set) |
--save_every |
50 |
Checkpoint frequency |
--fresh |
False |
Force fresh training, ignore existing checkpoints |
--single_channel |
False |
Confirm data is single-channel (for shallow 3D volumes like (8, 128, 128)) |
Performance
| Argument | Default | Description |
|---|---|---|
--compile |
False |
Enable torch.compile (recommended for long runs) |
--precision |
bf16 |
Mixed precision mode (bf16, fp16, no) |
--workers |
-1 |
DataLoader workers per GPU (-1=auto, up to 16) |
--wandb |
False |
Enable W&B logging |
--wandb_watch |
False |
Enable W&B gradient watching (adds overhead) |
--project_name |
DL-Training |
W&B project name |
--run_name |
None |
W&B run name (auto-generated if not set) |
Automatic GPU Optimizations:
WaveDL automatically enables performance optimizations for modern GPUs:
| Optimization | Effect | GPU Support |
|---|---|---|
| TF32 precision | ~2x speedup for float32 matmul | A100, H100 (Ampere+) |
| cuDNN benchmark | Auto-tuned convolutions | All NVIDIA GPUs |
| Worker scaling | Up to 16 workers per GPU | All systems |
[!NOTE] These optimizations are backward compatible — they have no effect on older GPUs (V100, T4, GTX) or CPU-only systems. No configuration needed.
HPC Best Practices:
- Stage data to
$SLURM_TMPDIR(local NVMe) for maximum I/O throughput - Use
--compilefor training runs > 50 epochs - Increase
--workersmanually if auto-detection is suboptimal
Environment Variables (wavedl-hpc)
| Variable | Default | Description |
|---|---|---|
NUM_GPUS |
Auto-detected | Number of GPUs to use. By default, automatically detected via nvidia-smi. Set explicitly to override (e.g., NUM_GPUS=2) |
NUM_MACHINES |
1 |
Number of machines in distributed setup |
MIXED_PRECISION |
bf16 |
Precision mode: bf16, fp16, or no |
DYNAMO_BACKEND |
no |
PyTorch Dynamo backend |
WANDB_MODE |
offline |
WandB mode: offline or online |
Loss Functions
| Loss | Flag | Best For | Notes |
|---|---|---|---|
mse |
--loss mse |
Default, smooth gradients | Standard Mean Squared Error |
mae |
--loss mae |
Outlier-robust, linear penalty | Mean Absolute Error (L1) |
huber |
--loss huber --huber_delta 1.0 |
Best of MSE + MAE | Robust, smooth transition |
smooth_l1 |
--loss smooth_l1 |
Similar to Huber | PyTorch native implementation |
log_cosh |
--loss log_cosh |
Smooth approximation to MAE | Differentiable everywhere |
weighted_mse |
--loss weighted_mse --loss_weights "2.0,1.0,1.0" |
Prioritize specific targets | Per-target weighting |
Example:
# Use Huber loss for noisy NDE data
accelerate launch -m wavedl.train --model cnn --loss huber --huber_delta 0.5
# Weighted MSE: prioritize thickness (first target)
accelerate launch -m wavedl.train --model cnn --loss weighted_mse --loss_weights "2.0,1.0,1.0"
Optimizers
| Optimizer | Flag | Best For | Key Parameters |
|---|---|---|---|
adamw |
--optimizer adamw |
Default, most cases | --betas "0.9,0.999" |
adam |
--optimizer adam |
Legacy compatibility | --betas "0.9,0.999" |
sgd |
--optimizer sgd |
Better generalization | --momentum 0.9 --nesterov |
nadam |
--optimizer nadam |
Adam + Nesterov | Faster convergence |
radam |
--optimizer radam |
Variance-adaptive | More stable training |
rmsprop |
--optimizer rmsprop |
RNN/LSTM models | --momentum 0.9 |
Example:
# SGD with Nesterov momentum (often better generalization)
accelerate launch -m wavedl.train --model cnn --optimizer sgd --lr 0.01 --momentum 0.9 --nesterov
# RAdam for more stable training
accelerate launch -m wavedl.train --model cnn --optimizer radam --lr 1e-3
Learning Rate Schedulers
| Scheduler | Flag | Best For | Key Parameters |
|---|---|---|---|
plateau |
--scheduler plateau |
Default, adaptive | --scheduler_patience 10 --scheduler_factor 0.5 |
cosine |
--scheduler cosine |
Long training, smooth decay | --min_lr 1e-6 |
cosine_restarts |
--scheduler cosine_restarts |
Escape local minima | Warm restarts |
onecycle |
--scheduler onecycle |
Fast convergence | Super-convergence |
step |
--scheduler step |
Simple decay | --step_size 30 --scheduler_factor 0.1 |
multistep |
--scheduler multistep |
Custom milestones | --milestones "30,60,90" |
exponential |
--scheduler exponential |
Continuous decay | --scheduler_factor 0.95 |
linear_warmup |
--scheduler linear_warmup |
Warmup phase | --warmup_epochs 5 |
Example:
# Cosine annealing for 1000 epochs
accelerate launch -m wavedl.train --model cnn --scheduler cosine --epochs 1000 --min_lr 1e-7
# OneCycleLR for super-convergence
accelerate launch -m wavedl.train --model cnn --scheduler onecycle --lr 1e-2 --epochs 50
# MultiStep with custom milestones
accelerate launch -m wavedl.train --model cnn --scheduler multistep --milestones "100,200,300"
Cross-Validation
For robust model evaluation, simply add the --cv flag:
# 5-fold cross-validation (works with both methods!)
wavedl-hpc --model cnn --cv 5 --data_path train_data.npz
# OR
accelerate launch -m wavedl.train --model cnn --cv 5 --data_path train_data.npz
# Stratified CV (recommended for unbalanced data)
wavedl-hpc --model cnn --cv 5 --cv_stratify --loss huber --epochs 100
# Full configuration
wavedl-hpc --model cnn --cv 5 --cv_stratify \
--loss huber --optimizer adamw --scheduler cosine \
--output_dir ./cv_results
| Argument | Default | Description |
|---|---|---|
--cv |
0 |
Number of CV folds (0=disabled, normal training) |
--cv_stratify |
False |
Use stratified splitting (bins targets) |
--cv_bins |
10 |
Number of bins for stratified CV |
Output:
cv_summary.json: Aggregated metrics (mean ± std)cv_results.csv: Per-fold detailed resultsfold_*/: Individual fold models and scalers
Configuration Files (YAML)
Use YAML files for reproducible experiments. CLI arguments can override any config value.
# Use a config file
accelerate launch -m wavedl.train --config configs/config.yaml --data_path train.npz
# Override specific values from config
accelerate launch -m wavedl.train --config configs/config.yaml --lr 5e-4 --epochs 500
Example config (configs/config.yaml):
# Model & Training
model: cnn
batch_size: 128
lr: 0.001
epochs: 1000
patience: 20
# Loss, Optimizer, Scheduler
loss: mse
optimizer: adamw
scheduler: plateau
# Cross-Validation (0 = disabled)
cv: 0
# Performance
precision: bf16
compile: false
seed: 2025
[!TIP] See
configs/config.yamlfor the complete template with all available options documented.
Hyperparameter Search (HPO)
Automatically find the best training configuration using Optuna.
Run HPO:
You specify which models to search and how many trials to run:
# Search 3 models with 100 trials
python -m wavedl.hpo --data_path train.npz --models cnn resnet18 efficientnet_b0 --n_trials 100
# Search 1 model (faster)
python -m wavedl.hpo --data_path train.npz --models cnn --n_trials 50
# Search all your candidate models
python -m wavedl.hpo --data_path train.npz --models cnn resnet18 resnet50 vit_small densenet121 --n_trials 200
Train with best parameters
After HPO completes, it prints the optimal command:
accelerate launch -m wavedl.train --data_path train.npz --model cnn --lr 3.2e-4 --batch_size 128 ...
What Gets Searched:
| Parameter | Default | You Can Override With |
|---|---|---|
| Models | cnn, resnet18, resnet34 | --models X Y Z |
| Optimizers | all 6 | --optimizers X Y |
| Schedulers | all 8 | --schedulers X Y |
| Losses | all 6 | --losses X Y |
| Learning rate | 1e-5 → 1e-2 | (always searched) |
| Batch size | 64, 128, 256, 512 | (always searched) |
Quick Mode (--quick):
- Uses minimal defaults: cnn + adamw + plateau + mse
- Faster for testing your setup before running full search
- You can still override any option with the flags above
All Arguments:
| Argument | Default | Description |
|---|---|---|
--data_path |
(required) | Training data file |
--models |
3 defaults | Models to search (specify any number) |
--n_trials |
50 |
Number of trials to run |
--quick |
False |
Use minimal defaults (faster) |
--optimizers |
all 6 | Optimizers to search |
--schedulers |
all 8 | Schedulers to search |
--losses |
all 6 | Losses to search |
--n_jobs |
1 |
Parallel trials (multi-GPU) |
--max_epochs |
50 |
Max epochs per trial |
--output |
hpo_results.json |
Output file |
[!TIP] See Available Models for all 38 architectures you can search.
📈 Data Preparation
WaveDL supports multiple data formats for training and inference:
| Format | Extension | Key Advantages |
|---|---|---|
| NPZ | .npz |
Native NumPy, fast loading, recommended |
| HDF5 | .h5, .hdf5 |
Large datasets, hierarchical, cross-platform |
| MAT | .mat |
MATLAB compatibility (v7.3+ only, saved with -v7.3 flag) |
The framework automatically detects file format and data dimensionality (1D, 2D, or 3D) — you only need to provide the appropriate model architecture.
| Key | Shape | Type | Description |
|---|---|---|---|
input_train / input_test |
(N, L), (N, H, W), or (N, D, H, W) |
float32 |
N samples of 1D/2D/3D representations |
output_train / output_test |
(N, T) |
float32 |
N samples with T regression targets |
[!TIP]
- Flexible Key Names: WaveDL auto-detects common key pairs:
input_train/output_train,input_test/output_test(WaveDL standard)X/Y,x/y(ML convention)data/labels,inputs/outputs,features/targets- Automatic Dimension Detection: Channel dimension is added automatically. No manual reshaping required!
- Sparse Matrix Support: NPZ and MAT v7.3 files with scipy/MATLAB sparse matrices are automatically converted to dense arrays.
- Auto-Normalization: Target values are automatically standardized during training. MAE is reported in original physical units.
[!IMPORTANT] MATLAB Users: MAT files must be saved with the
-v7.3flag for memory-efficient loading:save('data.mat', 'input_train', 'output_train', '-v7.3')Older MAT formats (v5/v7) are not supported. Convert to NPZ for best compatibility.
Example: Basic Preparation
import numpy as np
X = np.array(images, dtype=np.float32) # (N, H, W)
y = np.array(labels, dtype=np.float32) # (N, T)
np.savez('train_data.npz', input_train=X, output_train=y)
Example: From Image Files + CSV
import numpy as np
from PIL import Image
from pathlib import Path
import pandas as pd
# Load images
images = [np.array(Image.open(f).convert('L'), dtype=np.float32)
for f in sorted(Path("images/").glob("*.png"))]
X = np.stack(images)
# Load labels
y = pd.read_csv("labels.csv").values.astype(np.float32)
np.savez('train_data.npz', input_train=X, output_train=y)
Example: From MATLAB (.mat)
import numpy as np
from scipy.io import loadmat
data = loadmat('simulation_data.mat')
X = data['spectrograms'].astype(np.float32) # Adjust key
y = data['parameters'].astype(np.float32)
# Transpose if needed: (H, W, N) → (N, H, W)
if X.ndim == 3 and X.shape[2] < X.shape[0]:
X = np.transpose(X, (2, 0, 1))
np.savez('train_data.npz', input_train=X, output_train=y)
Example: Synthetic Test Data
import numpy as np
X = np.random.randn(1000, 256, 256).astype(np.float32)
y = np.random.randn(1000, 5).astype(np.float32)
np.savez('test_data.npz', input_test=X, output_test=y)
Validation Script
import numpy as np
data = np.load('train_data.npz')
assert data['input_train'].ndim >= 2, "Input must be at least 2D: (N, ...) "
assert data['output_train'].ndim == 2, "Output must be 2D: (N, T)"
assert len(data['input_train']) == len(data['output_train']), "Sample mismatch"
print(f"✓ Input: {data['input_train'].shape} {data['input_train'].dtype}")
print(f"✓ Output: {data['output_train'].shape} {data['output_train'].dtype}")
📦 Examples 
The examples/ folder contains a complete, ready-to-run example for material characterization of isotropic plates. The pre-trained CNN predicts three physical parameters from Lamb wave dispersion curves:
| Parameter | Unit | Description |
|---|---|---|
| h | mm | Plate thickness |
| √(E/ρ) | km/s | Square root of Young's modulus over density |
| ν | — | Poisson's ratio |
[!NOTE] This example is based on our paper at SPIE Smart Structures + NDE 2026: "Deep learning-based ultrasonic assessment of plate thickness and elasticity" (Paper 13951-4, to appear).
Try it yourself:
# Run inference on the example data
python -m wavedl.test --checkpoint ./examples/elastic_cnn_example/best_checkpoint \
--data_path ./examples/elastic_cnn_example/Test_data_100.mat \
--plot --save_predictions --output_dir ./examples/elastic_cnn_example/test_results
# Export to ONNX (already included as model.onnx)
python -m wavedl.test --checkpoint ./examples/elastic_cnn_example/best_checkpoint \
--data_path ./examples/elastic_cnn_example/Test_data_100.mat \
--export onnx --export_path ./examples/elastic_cnn_example/model.onnx
What's Included:
| File | Description |
|---|---|
best_checkpoint/ |
Pre-trained CNN checkpoint |
Test_data_100.mat |
100 sample test set (500×500 dispersion curves → h, √(E/ρ), ν) |
model.onnx |
ONNX export with embedded de-normalization |
training_history.csv |
Epoch-by-epoch training metrics (loss, R², LR, etc.) |
training_curves.png |
Training/validation loss and learning rate plot |
test_results/ |
Example predictions and diagnostic plots |
WaveDL_ONNX_Inference.m |
MATLAB script for ONNX inference |
Training Progress:
Training and validation loss over 162 epochs with learning rate schedule
Inference Results:
Figure 1: Predictions vs ground truth for all three elastic parameters
Figure 2: Distribution of prediction errors showing near-zero mean bias
Figure 3: Residuals vs predicted values (no heteroscedasticity detected)
Figure 4: Bland-Altman analysis with ±1.96 SD limits of agreement
Figure 5: Q-Q plots confirming normally distributed prediction errors
Figure 6: Error correlation matrix between parameters
Figure 7: Relative error (%) vs true value for each parameter
Figure 8: Cumulative error distribution — 95% of predictions within indicated bounds
Figure 9: True vs predicted values by sample index
Figure 10: Error distribution summary (median, quartiles, outliers)
🔬 Broader Applications
Beyond the material characterization example above, the WaveDL pipeline can be adapted for a wide range of wave-based inverse problems across multiple domains:
🏗️ Non-Destructive Evaluation & Structural Health Monitoring
| Application | Input | Output |
|---|---|---|
| Defect Sizing | A-scans, phased array images, FMC/TFM, ... | Crack length, depth, ... |
| Corrosion Estimation | Thickness maps, resonance spectra, ... | Wall thickness, corrosion rate, ... |
| Weld Quality Assessment | Phased array images, TOFD, ... | Porosity %, penetration depth, ... |
| RUL Prediction | Acoustic emission (AE), vibration spectra, ... | Cycles to failure, ... |
| Damage Localization | Wavefield images, DAS/DVS data, ... | Damage coordinates (x, y, z) |
🌍 Geophysics & Seismology
| Application | Input | Output |
|---|---|---|
| Seismic Inversion | Shot gathers, seismograms, ... | Velocity models, density profiles, ... |
| Subsurface Characterization | Surface wave dispersion, receiver functions, ... | Layer thickness, shear modulus, ... |
| Earthquake Source Parameters | Waveforms, spectrograms, ... | Magnitude, depth, focal mechanism, ... |
| Reservoir Characterization | Reflection seismic, AVO attributes, ... | Porosity, fluid saturation, ... |
🩺 Biomedical Ultrasound & Elastography
| Application | Input | Output |
|---|---|---|
| Tissue Elastography | Shear wave data, strain images, ... | Shear modulus, Young's modulus, ... |
| Liver Fibrosis Staging | Elastography images, US RF data, ... | Stiffness (kPa), fibrosis score, ... |
| Tumor Characterization | B-mode + elastography, ARFI data, ... | Lesion stiffness, size, ... |
| Bone QUS | Axial-transmission signals, ... | Porosity, cortical thickness, elastic modulus ... |
[!NOTE] Adapting WaveDL to these applications requires preparing your own dataset and choosing a suitable model architecture to match your input dimensionality.
📚 Documentation
| Resource | Description |
|---|---|
| Technical Paper | In-depth framework description (coming soon) |
_template.py |
Template for custom architectures |
📜 Citation
If you use WaveDL in your research, please cite:
@software{le2025wavedl,
author = {Le, Ductho},
title = {{WaveDL}: A Scalable Deep Learning Framework for Wave-Based Inverse Problems},
year = {2025},
publisher = {Zenodo},
doi = {10.5281/zenodo.18012338},
url = {https://doi.org/10.5281/zenodo.18012338}
}
Or in APA format:
Le, D. (2025). WaveDL: A Scalable Deep Learning Framework for Wave-Based Inverse Problems. Zenodo. https://doi.org/10.5281/zenodo.18012338
🙏 Acknowledgments
Ductho Le would like to acknowledge NSERC and Alberta Innovates for supporting his study and research by means of a research assistantship and a graduate doctoral fellowship.
This research was enabled in part by support provided by Compute Ontario, Calcul Québec, and the Digital Research Alliance of Canada.
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