""" Example 3 — Unconditional VAE: Melt-Pool Side Profiles Trains a minimal convolutional VAE on side-profile images and generates new samples. No conditioning on process parameters. Images are loaded from frames/side/ — already border-recolored by the dataset pipeline. Only frames labeled Keyhole or Conduction are used (Initial Emptiness and Forming Phase are excluded). Architecture: 3×32×64 → latent z (dim=16) → 3×32×64 Set MAX_IMAGES to limit dataset size for a quick reviewer run. Set MAX_IMAGES = None to use all available images. Outputs saved to runs/generation_/: generation_epoch_NNN.png — sample grid every SAMPLE_EVERY epochs generation_loss.png — training loss curve generation_reconstructions.png generation_samples.png run.log This is a proof-of-concept, not a benchmark. """ import csv import logging import sys from datetime import datetime from pathlib import Path import numpy as np import torch import torch.nn as nn from torch.utils.data import DataLoader, TensorDataset from PIL import Image as PILImage import matplotlib.pyplot as plt # ------------------------------------------------------------------ # Config ← edit DATA_DIRS to point at your data directories # ------------------------------------------------------------------ DATA_DIRS = [ Path(__file__).parent.parent / "rnl" / "final_data_processed", Path(__file__).parent.parent / "rnl" / "lrz_data_new_format", ] OUT_ROOT = Path(__file__).parent.parent / "runs" MAX_IMAGES = 500 # reviewer-friendly cap (None = all images) IMG_W = 64 IMG_H = 32 LATENT_DIM = 16 BATCH_SIZE = 64 EPOCHS = 50 LR = 1e-3 SAMPLE_EVERY = 10 RED_WEIGHT = 50.0 RANDOM_SEED = 42 DEVICE = "cuda" if torch.cuda.is_available() else "cpu" VALID_LABELS = {"Keyhole", "Conduction"} # ------------------------------------------------------------------ # Logger # ------------------------------------------------------------------ class _ColorFormatter(logging.Formatter): _COLORS = {logging.INFO: "\033[32m", logging.WARNING: "\033[33m", logging.ERROR: "\033[31m"} _RESET = "\033[0m"; _BOLD = "\033[1m" def format(self, record): color = self._COLORS.get(record.levelno, self._RESET) t = self.formatTime(record, "%H:%M:%S") return f"{self._BOLD}{t}{self._RESET} {color}{record.levelname:<8}{self._RESET} {record.getMessage()}" run_id = datetime.now().strftime("%Y%m%d_%H%M%S") out_dir = OUT_ROOT / f"generation_{run_id}" out_dir.mkdir(parents=True, exist_ok=True) log = logging.getLogger("vae") log.setLevel(logging.DEBUG) _ch = logging.StreamHandler(sys.stdout); _ch.setFormatter(_ColorFormatter()); log.addHandler(_ch) _fh = logging.FileHandler(out_dir / "run.log") _fh.setFormatter(logging.Formatter("%(asctime)s %(levelname)-8s %(message)s", datefmt="%H:%M:%S")) log.addHandler(_fh) log.info("=" * 60) log.info(f"Run ID : {run_id}") log.info(f"Results : {out_dir}") log.info(f"Device : {DEVICE}") log.info(f"Resolution: {IMG_W}×{IMG_H}") log.info("=" * 60) # ------------------------------------------------------------------ # 1. Collect valid image paths from frames.csv # ------------------------------------------------------------------ img_paths = [] for data_dir in DATA_DIRS: if not data_dir.is_dir(): continue for sim_dir in sorted(data_dir.iterdir()): frames_csv = sim_dir / "frames.csv" if not frames_csv.exists(): continue for row in csv.DictReader(frames_csv.open()): if row["label"] not in VALID_LABELS: continue path = sim_dir / row["side_filename"] if path.exists(): img_paths.append(path) import random rng = random.Random(RANDOM_SEED) rng.shuffle(img_paths) if MAX_IMAGES is not None: img_paths = img_paths[:MAX_IMAGES] log.info(f"Found {len(img_paths)} valid side-profile frames") # ------------------------------------------------------------------ # 2. Load images (already border-recolored — just resize) # ------------------------------------------------------------------ log.info("Loading images ...") imgs = [] for path in img_paths: pil = PILImage.open(path).convert("RGB").resize((IMG_W, IMG_H), PILImage.Resampling.BILINEAR) imgs.append(np.array(pil)) data = torch.from_numpy( np.stack(imgs).astype(np.float32) / 255.0 ).permute(0, 3, 1, 2) # N×3×H×W loader = DataLoader(TensorDataset(data), batch_size=BATCH_SIZE, shuffle=True, generator=torch.Generator().manual_seed(RANDOM_SEED)) log.info(f"Tensor shape: {tuple(data.shape)}") # ------------------------------------------------------------------ # 3. Convolutional VAE (3×32×64 input) # # Encoder spatial progression (H×W): # 3×32×64 → 32×16×32 → 64×8×16 → 128×4×8 → 256×2×4 # Flatten → 2048 → mu / logvar (dim=16) # ------------------------------------------------------------------ class Encoder(nn.Module): def __init__(self, latent_dim): super().__init__() self.conv = nn.Sequential( nn.Conv2d(3, 32, 4, 2, 1), nn.ReLU(), nn.Conv2d(32, 64, 4, 2, 1), nn.ReLU(), nn.Conv2d(64, 128, 4, 2, 1), nn.ReLU(), nn.Conv2d(128, 256, 4, 2, 1), nn.ReLU(), ) self.fc_mu = nn.Linear(256 * 2 * 4, latent_dim) self.fc_logvar = nn.Linear(256 * 2 * 4, latent_dim) def forward(self, x): h = self.conv(x).flatten(1) return self.fc_mu(h), self.fc_logvar(h) class Decoder(nn.Module): def __init__(self, latent_dim): super().__init__() self.fc = nn.Linear(latent_dim, 256 * 2 * 4) self.deconv = nn.Sequential( nn.ConvTranspose2d(256, 128, 4, 2, 1), nn.ReLU(), nn.ConvTranspose2d(128, 64, 4, 2, 1), nn.ReLU(), nn.ConvTranspose2d(64, 32, 4, 2, 1), nn.ReLU(), nn.ConvTranspose2d(32, 3, 4, 2, 1), nn.Sigmoid(), ) def forward(self, z): return self.deconv(self.fc(z).view(-1, 256, 2, 4)) class VAE(nn.Module): def __init__(self, latent_dim): super().__init__() self.encoder = Encoder(latent_dim) self.decoder = Decoder(latent_dim) def reparameterise(self, mu, logvar): return mu + (0.5 * logvar).exp() * torch.randn_like(mu) def forward(self, x): mu, logvar = self.encoder(x) return self.decoder(self.reparameterise(mu, logvar)), mu, logvar def vae_loss(recon, x, mu, logvar): # Upweight melt-pool pixels (red channel dominant) so the VAE # doesn't ignore the small pool region against the background. mask = ((x[:, 0] > 0.5) & (x[:, 1] < 0.25) & (x[:, 2] < 0.25)).unsqueeze(1).float() weights = 1.0 + (RED_WEIGHT - 1.0) * mask.expand_as(x) recon_loss = (weights * (recon - x).pow(2)).sum() kld = -0.5 * torch.sum(1 + logvar - mu.pow(2) - logvar.exp()) return recon_loss + kld # ------------------------------------------------------------------ # 4. Train # ------------------------------------------------------------------ torch.manual_seed(RANDOM_SEED) model = VAE(LATENT_DIM).to(DEVICE) opt = torch.optim.Adam(model.parameters(), lr=LR) z_fixed = torch.randn(16, LATENT_DIM, device=DEVICE) loss_log = [] log.info(f"Training VAE for {EPOCHS} epochs | {len(data)} images | batch={BATCH_SIZE}") for epoch in range(1, EPOCHS + 1): model.train() total = 0.0 for (batch,) in loader: batch = batch.to(DEVICE) recon, mu, logvar = model(batch) loss = vae_loss(recon, batch, mu, logvar) opt.zero_grad(); loss.backward(); opt.step() total += loss.item() loss_per_img = total / len(data) loss_log.append(loss_per_img) log.info(f" epoch {epoch:3d}/{EPOCHS} loss/img: {loss_per_img:.4f}") if epoch % SAMPLE_EVERY == 0: model.eval() with torch.no_grad(): samples = model.decoder(z_fixed).cpu().permute(0, 2, 3, 1).numpy() fig, axes = plt.subplots(2, 8, figsize=(14, 4)) for i, ax in enumerate(axes.flat): ax.imshow(samples[i]); ax.axis("off") fig.suptitle(f"VAE samples — epoch {epoch}/{EPOCHS} (loss/img={loss_per_img:.4f})", fontsize=10) plt.tight_layout() path = out_dir / f"generation_epoch_{epoch:03d}.png" plt.savefig(path, dpi=100); plt.close(fig) log.info(f" → saved {path.name}") # ------------------------------------------------------------------ # 5. Final plots # ------------------------------------------------------------------ model.eval() log.info("Generating final plots ...") fig, ax = plt.subplots(figsize=(7, 3)) ax.plot(range(1, EPOCHS + 1), loss_log, lw=1.5) ax.set_xlabel("Epoch"); ax.set_ylabel("Loss / image") ax.set_title("VAE training loss") plt.tight_layout() plt.savefig(out_dir / "generation_loss.png", dpi=150); plt.close(fig) N_SHOW = 8 with torch.no_grad(): originals = data[:N_SHOW].to(DEVICE) recons, _, _ = model(originals) originals = originals.cpu().permute(0, 2, 3, 1).numpy() recons = recons.cpu().permute(0, 2, 3, 1).numpy() samples = model.decoder(torch.randn(16, LATENT_DIM, device=DEVICE)).cpu().permute(0, 2, 3, 1).numpy() fig, axes = plt.subplots(2, N_SHOW, figsize=(14, 3)) for i in range(N_SHOW): axes[0, i].imshow(originals[i]); axes[0, i].axis("off") axes[1, i].imshow(recons[i]); axes[1, i].axis("off") axes[0, 0].set_ylabel("Real", rotation=0, labelpad=30, va="center") axes[1, 0].set_ylabel("Recon", rotation=0, labelpad=30, va="center") fig.suptitle("VAE reconstructions — melt-pool side profiles", fontsize=11) plt.tight_layout() plt.savefig(out_dir / "generation_reconstructions.png", dpi=150); plt.close(fig) fig, axes = plt.subplots(2, 8, figsize=(14, 4)) for i, ax in enumerate(axes.flat): ax.imshow(samples[i]); ax.axis("off") fig.suptitle("Unconditional VAE samples — melt-pool side profiles", fontsize=11) plt.tight_layout() plt.savefig(out_dir / "generation_samples.png", dpi=150); plt.close(fig) log.info(f"All outputs saved to {out_dir}") log.info("Done.")