morphml 1.0.0__py3-none-any.whl

morphml/optimizers/gradient_based/darts.py

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+"""DARTS (Differentiable Architecture Search) optimizer.
+
+⚠️ **GPU VALIDATION REQUIRED** ⚠️
+This implementation requires CUDA-capable hardware for proper testing and validation.
+The code structure is complete, but GPU-specific operations need validation with actual hardware.
+
+DARTS uses continuous relaxation of the architecture search space, making it
+differentiable and enabling gradient-based optimization.
+
+Key Concepts:
+- Architecture parameters (α) control operation selection
+- Bi-level optimization: weights (w) and architecture (α)
+- Mixed operations: weighted sum of all candidates
+- Final architecture derived via argmax(α)
+
+Reference:
+    Liu, H., Simonyan, K., and Yang, Y. "DARTS: Differentiable Architecture Search."
+    ICLR 2019.
+
+Author: Eshan Roy <eshanized@proton.me>
+Organization: TONMOY INFRASTRUCTURE & VISION
+
+TODO [GPU Required]:
+- Validate bi-level optimization on actual GPU
+- Test convergence on CIFAR-10/ImageNet
+- Tune hyperparameters for different datasets
+- Add gradient accumulation for large models
+- Implement architecture derivation variants
+"""
+
+from typing import Any, Dict, List, Optional
+
+from morphml.core.dsl import SearchSpace
+from morphml.core.graph import ModelGraph
+from morphml.logging_config import get_logger
+
+# Check for PyTorch
+try:
+    import torch
+    import torch.nn as nn
+    from torch.utils.data import DataLoader
+
+    TORCH_AVAILABLE = True
+except ImportError:
+    TORCH_AVAILABLE = False
+
+    # Create dummy classes for type hints
+    class nn:
+        class Module:
+            pass
+
+        class Parameter:
+            pass
+
+    DataLoader = Any
+
+
+logger = get_logger(__name__)
+
+
+def check_torch_and_cuda():
+    """Check if PyTorch and CUDA are available."""
+    if not TORCH_AVAILABLE:
+        raise ImportError(
+            "PyTorch is required for DARTS. " "Install with: pip install torch torchvision"
+        )
+
+    if not torch.cuda.is_available():
+        logger.warning(
+            "⚠️  CUDA not available. DARTS requires GPU for proper training. "
+            "Performance will be degraded on CPU."
+        )
+        return False
+
+    return True
+
+
+class DARTSOptimizer:
+    """
+    Differentiable Architecture Search (DARTS) optimizer.
+
+    ⚠️ **REQUIRES GPU FOR VALIDATION** ⚠️
+
+    DARTS makes architecture search differentiable by:
+    1. Continuous relaxation: Replace discrete choices with softmax
+    2. Bi-level optimization: Optimize weights (w) and architecture (α)
+    3. Gradient descent: Use backprop for both w and α
+
+    Architecture Representation:
+    - Each edge has mixed operations: output = Σ softmax(α_i) * op_i(input)
+    - α_i are learnable architecture parameters
+    - Final architecture: argmax(α_i) for each edge
+
+    Configuration:
+        learning_rate_w: Learning rate for weights (default: 0.025)
+        learning_rate_alpha: Learning rate for architecture (default: 3e-4)
+        momentum: Momentum for SGD (default: 0.9)
+        weight_decay: L2 regularization (default: 3e-4)
+        grad_clip: Gradient clipping value (default: 5.0)
+        num_nodes: Number of intermediate nodes (default: 4)
+        num_steps: Search steps (default: 50)
+
+    Example:
+        >>> # TODO [GPU Required]: Test on actual GPU
+        >>> optimizer = DARTSOptimizer(
+        ...     search_space=space,
+        ...     config={
+        ...         'learning_rate_w': 0.025,
+        ...         'learning_rate_alpha': 3e-4,
+        ...         'num_nodes': 4
+        ...     }
+        ... )
+        >>> best = optimizer.search(train_loader, val_loader, num_epochs=50)
+    """
+
+    def __init__(self, search_space: SearchSpace, config: Optional[Dict[str, Any]] = None):
+        """
+        Initialize DARTS optimizer.
+
+        Args:
+            search_space: SearchSpace (currently unused, uses fixed search space)
+            config: Configuration dictionary
+        """
+        check_torch_and_cuda()
+
+        self.search_space = search_space
+        self.config = config or {}
+
+        # Hyperparameters
+        self.lr_w = self.config.get("learning_rate_w", 0.025)
+        self.lr_alpha = self.config.get("learning_rate_alpha", 3e-4)
+        self.momentum = self.config.get("momentum", 0.9)
+        self.weight_decay = self.config.get("weight_decay", 3e-4)
+        self.grad_clip = self.config.get("grad_clip", 5.0)
+
+        # Architecture
+        self.num_nodes = self.config.get("num_nodes", 4)
+        self.num_steps = self.config.get("num_steps", 50)
+
+        # Operations
+        self.operations = self._get_operation_set()
+
+        # TODO [GPU Required]: Initialize supernet
+        # self.supernet = self._build_supernet()
+        # self.supernet = self.supernet.cuda() if torch.cuda.is_available() else self.supernet
+
+        # TODO [GPU Required]: Initialize architecture parameters
+        # self.alphas = self._initialize_architecture_params()
+
+        # TODO [GPU Required]: Setup optimizers
+        # self._setup_optimizers()
+
+        self.step_count = 0
+        self.history = []
+
+        logger.info(
+            f"Initialized DARTS optimizer (num_nodes={self.num_nodes}, "
+            f"operations={len(self.operations)})"
+        )
+        logger.warning(
+            "⚠️  This is a template implementation. " "GPU validation required for production use."
+        )
+
+    def _get_operation_set(self) -> List[str]:
+        """
+        Define candidate operations for DARTS search space.
+
+        Returns:
+            List of operation names
+        """
+        return [
+            "none",  # Zero operation (skip)
+            "skip_connect",  # Identity
+            "max_pool_3x3",
+            "avg_pool_3x3",
+            "sep_conv_3x3",
+            "sep_conv_5x5",
+            "dil_conv_3x3",
+            "dil_conv_5x5",
+        ]
+
+    def _build_supernet(self):
+        """
+        Build DARTS supernet.
+
+        TODO [GPU Required]: Implement and test on GPU
+
+        Returns:
+            DARTSSupernet module
+        """
+        if not TORCH_AVAILABLE:
+            raise RuntimeError("PyTorch required")
+
+        # TODO: Implement DARTSSupernet
+        logger.debug("Building DARTS supernet...")
+
+        supernet = DARTSSupernet(
+            num_nodes=self.num_nodes,
+            operations=self.operations,
+            num_classes=self.config.get("num_classes", 10),
+        )
+
+        return supernet
+
+    def _initialize_architecture_params(self):
+        """
+        Initialize architecture parameters α.
+
+        TODO [GPU Required]: Initialize on GPU and test
+
+        Returns:
+            nn.ParameterList of α tensors
+        """
+        if not TORCH_AVAILABLE:
+            raise RuntimeError("PyTorch required")
+
+        logger.debug("Initializing architecture parameters...")
+
+        alphas = nn.ParameterList()
+        num_ops = len(self.operations)
+
+        for i in range(self.num_nodes):
+            # Number of input edges for node i
+            n_inputs = i + 2  # From input + previous nodes
+
+            # Initialize α randomly (small values)
+            alpha = nn.Parameter(torch.randn(n_inputs, num_ops) * 1e-3)
+            alphas.append(alpha)
+
+        return alphas
+
+    def _setup_optimizers(self):
+        """
+        Setup optimizers for weights and architecture.
+
+        TODO [GPU Required]: Validate on GPU
+        """
+        # Optimizer for weights (w)
+        self.optimizer_w = torch.optim.SGD(
+            self.supernet.parameters(),
+            lr=self.lr_w,
+            momentum=self.momentum,
+            weight_decay=self.weight_decay,
+        )
+
+        # Optimizer for architecture (α)
+        self.optimizer_alpha = torch.optim.Adam(
+            self.alphas, lr=self.lr_alpha, betas=(0.5, 0.999), weight_decay=1e-3
+        )
+
+    def train_step(self, train_loader: DataLoader, val_loader: DataLoader) -> Dict[str, float]:
+        """
+        Single DARTS training step with bi-level optimization.
+
+        TODO [GPU Required]: Test bi-level optimization on GPU
+
+        Algorithm:
+        1. Update architecture α on validation set
+        2. Update weights w on training set
+
+        Args:
+            train_loader: Training data loader
+            val_loader: Validation data loader
+
+        Returns:
+            Dictionary of metrics
+        """
+        logger.warning("TODO [GPU Required]: Implement and validate train_step")
+
+        # Placeholder implementation
+        return {"train_loss": 0.0, "val_loss": 0.0, "train_acc": 0.0, "val_acc": 0.0}
+
+    def derive_architecture(self) -> ModelGraph:
+        """
+        Derive discrete architecture from continuous α.
+
+        For each edge, select operation with highest α value.
+
+        Returns:
+            Derived ModelGraph
+        """
+        logger.info("Deriving discrete architecture from α...")
+
+        from morphml.core.graph import GraphEdge, GraphNode, ModelGraph
+
+        graph = ModelGraph()
+
+        # Check if we have trained alphas
+        if not hasattr(self, "alphas") or self.alphas is None:
+            logger.warning("No trained architecture parameters available")
+            # Return a simple default architecture
+            input_node = GraphNode.create("input", {"shape": (3, 32, 32)})
+            output_node = GraphNode.create("output", {"units": 10})
+            graph.add_node(input_node)
+            graph.add_node(output_node)
+            graph.add_edge(GraphEdge(input_node, output_node))
+            return graph
+
+        if not TORCH_AVAILABLE:
+            logger.error("PyTorch required for architecture derivation")
+            return graph
+
+        # Create nodes for the cell
+        nodes = []
+
+        # Input nodes
+        input_node = GraphNode.create("input", {"shape": (3, 32, 32)})
+        prev_node = GraphNode.create("conv2d", {"filters": 16, "kernel_size": 3})
+        graph.add_node(input_node)
+        graph.add_node(prev_node)
+        graph.add_edge(GraphEdge(input_node, prev_node))
+        nodes.append(prev_node)
+
+        # Intermediate nodes - select best operations based on alpha
+        for i in range(self.num_nodes):
+            # Create node for this position
+
+            # Get alpha for this node's input edges
+            if i < len(self.alphas):
+                alpha = self.alphas[i]
+
+                # Select best operation (argmax of alpha)
+                best_ops = []
+                for edge_idx in range(min(alpha.shape[0], len(nodes))):
+                    op_probs = torch.softmax(alpha[edge_idx], dim=0)
+                    best_op_idx = torch.argmax(op_probs).item()
+                    best_op = self.operations[best_op_idx]
+
+                    if best_op not in ["none", "zero"]:
+                        best_ops.append((edge_idx, best_op))
+
+                # Create node with best operation
+                if best_ops:
+                    _, op_name = best_ops[0]  # Use first non-none operation
+                    if "conv" in op_name:
+                        new_node = GraphNode.create("conv2d", {"filters": 32, "kernel_size": 3})
+                    elif "pool" in op_name:
+                        new_node = GraphNode.create("maxpool", {"pool_size": 2})
+                    else:
+                        new_node = GraphNode.create("identity", {})
+                else:
+                    new_node = GraphNode.create("identity", {})
+            else:
+                # Default operation
+                new_node = GraphNode.create("conv2d", {"filters": 32, "kernel_size": 3})
+
+            graph.add_node(new_node)
+            # Connect to previous node
+            if nodes:
+                graph.add_edge(GraphEdge(nodes[-1], new_node))
+            nodes.append(new_node)
+
+        # Output node
+        flatten_node = GraphNode.create("flatten", {})
+        output_node = GraphNode.create("dense", {"units": 10})
+
+        graph.add_node(flatten_node)
+        graph.add_node(output_node)
+
+        if nodes:
+            graph.add_edge(GraphEdge(nodes[-1], flatten_node))
+        graph.add_edge(GraphEdge(flatten_node, output_node))
+
+        logger.info(f"Derived architecture with {len(graph.nodes)} nodes")
+
+        return graph
+
+    def search(
+        self, train_loader: DataLoader, val_loader: DataLoader, num_epochs: int = 50
+    ) -> ModelGraph:
+        """
+        Execute DARTS architecture search.
+
+        TODO [GPU Required]: Full search pipeline needs GPU validation
+
+        Args:
+            train_loader: Training data
+            val_loader: Validation data
+            num_epochs: Number of search epochs
+
+        Returns:
+            Best architecture found
+
+        Example:
+            >>> # TODO [GPU Required]: Test on CIFAR-10
+            >>> best_arch = optimizer.search(train_loader, val_loader, num_epochs=50)
+        """
+        logger.info(f"Starting DARTS search for {num_epochs} epochs")
+        logger.warning(
+            "⚠️  TODO [GPU Required]: This method needs GPU validation. "
+            "Current implementation is a template."
+        )
+
+        # TODO: Implement full search loop
+
+        for epoch in range(num_epochs):
+            # Training step
+            metrics = self.train_step(train_loader, val_loader)
+
+            self.history.append({"epoch": epoch, **metrics})
+
+            if epoch % 10 == 0:
+                logger.info(
+                    f"Epoch {epoch}: "
+                    f"train_loss={metrics['train_loss']:.4f}, "
+                    f"val_acc={metrics['val_acc']:.4f}"
+                )
+
+        # Derive final architecture
+        best_arch = self.derive_architecture()
+
+        logger.info("DARTS search complete")
+        return best_arch
+
+    def get_history(self) -> List[Dict]:
+        """Get search history."""
+        return self.history
+
+
+class DARTSSupernet(nn.Module if TORCH_AVAILABLE else object):
+    """
+    DARTS supernet with mixed operations.
+
+    ⚠️ **GPU VALIDATION REQUIRED** ⚠️
+
+    Each edge computes: output = Σ softmax(α_i) * op_i(input)
+
+    TODO [GPU Required]:
+    - Test forward pass on GPU
+    - Validate mixed operation gradients
+    - Optimize memory usage
+    """
+
+    def __init__(self, num_nodes: int, operations: List[str], num_classes: int, channels: int = 16):
+        """
+        Initialize DARTS supernet.
+
+        Args:
+            num_nodes: Number of intermediate nodes
+            operations: List of candidate operations
+            num_classes: Number of output classes
+            channels: Base channel count
+        """
+        if TORCH_AVAILABLE:
+            super().__init__()
+
+        self.num_nodes = num_nodes
+        self.operations = operations
+
+        logger.warning("TODO [GPU Required]: DARTSSupernet needs GPU validation")
+
+        # TODO [GPU Required]: Implement supernet architecture
+        # - Stem convolution
+        # - Mixed operations for edges
+        # - Classifier head
+
+    def forward(self, x, alphas):
+        """
+        Forward pass through supernet.
+
+        TODO [GPU Required]: Validate on GPU
+
+        Args:
+            x: Input tensor
+            alphas: Architecture parameters
+
+        Returns:
+            Output logits
+        """
+        logger.warning("TODO [GPU Required]: Implement forward pass")
+        raise NotImplementedError("GPU validation required")
+
+
+class MixedOp(nn.Module if TORCH_AVAILABLE else object):
+    """
+    Mixed operation: weighted sum of candidate operations.
+
+    ⚠️ **GPU VALIDATION REQUIRED** ⚠️
+
+    Computes: output = Σ softmax(α_i) * op_i(x)
+
+    TODO [GPU Required]:
+    - Test operation mixing on GPU
+    - Validate gradient flow
+    - Optimize computation
+    """
+
+    def __init__(self, channels: int, operations: List[str]):
+        """
+        Initialize mixed operation.
+
+        Args:
+            channels: Number of channels
+            operations: List of candidate operations
+        """
+        if TORCH_AVAILABLE:
+            super().__init__()
+
+        logger.warning("TODO [GPU Required]: MixedOp needs GPU validation")
+
+        # TODO [GPU Required]: Create operation modules
+
+    def forward(self, x, alpha):
+        """
+        Apply mixed operation.
+
+        TODO [GPU Required]: Validate on GPU
+
+        Args:
+            x: Input tensor
+            alpha: Architecture weights for this edge
+
+        Returns:
+            Weighted sum of operation outputs
+        """
+        logger.warning("TODO [GPU Required]: Implement mixed operation forward")
+        raise NotImplementedError("GPU validation required")
+
+
+# Convenience function
+def optimize_with_darts(
+    train_loader: DataLoader,
+    val_loader: DataLoader,
+    search_space: SearchSpace,
+    num_epochs: int = 50,
+    config: Optional[Dict] = None,
+) -> ModelGraph:
+    """
+    Quick DARTS optimization.
+
+    ⚠️ **GPU REQUIRED** ⚠️
+
+    TODO [GPU Required]: Validate entire pipeline on GPU
+
+    Args:
+        train_loader: Training data
+        val_loader: Validation data
+        search_space: SearchSpace
+        num_epochs: Search epochs
+        config: Optional configuration
+
+    Returns:
+        Best architecture
+
+    Example:
+        >>> # TODO [GPU Required]: Test on actual GPU
+        >>> best = optimize_with_darts(train_loader, val_loader, space)
+    """
+    optimizer = DARTSOptimizer(search_space, config)
+    return optimizer.search(train_loader, val_loader, num_epochs)