# Modified from facebookresearch's DiT repos # DiT: https://github.com/facebookresearch/DiT/blob/main/models.py # Copyright (c) Meta Platforms, Inc. and affiliates. # All rights reserved. # This source code is licensed under the license found in the # LICENSE file in the root directory of this source tree. # -------------------------------------------------------- # References: # GLIDE: https://github.com/openai/glide-text2im # MAE: https://github.com/facebookresearch/mae/blob/main/models_mae.py # -------------------------------------------------------- from typing import Optional, Tuple import torch import torch.nn as nn import numpy as np import math from timm.models.vision_transformer import PatchEmbed, Mlp, RmsNorm, Attention from torch.nn import functional as F def modulate(x, shift, scale): return x * (1 + scale.unsqueeze(1)) + shift.unsqueeze(1) ################################################################################# # Embedding Layers for Timesteps and conditions # ################################################################################# def maybe_add_mask(scores: torch.Tensor, attn_mask: Optional[torch.Tensor] = None): return scores if attn_mask is None else scores + attn_mask class TimestepEmbedder(nn.Module): """ Embeds scalar timesteps into vector representations. """ def __init__(self, hidden_size, frequency_embedding_size=256): super().__init__() self.mlp = nn.Sequential( nn.Linear(frequency_embedding_size, hidden_size, bias=True), nn.SiLU(), nn.Linear(hidden_size, hidden_size, bias=True), ) self.frequency_embedding_size = frequency_embedding_size @staticmethod def timestep_embedding(t, dim, max_period=10000): """ Create sinusoidal timestep embeddings. :param t: a 1-D Tensor of N indices, one per batch element. These may be fractional. :param dim: the dimension of the output. :param max_period: controls the minimum frequency of the embeddings. :return: an (N, D) Tensor of positional embeddings. """ # https://github.com/openai/glide-text2im/blob/main/glide_text2im/nn.py half = dim // 2 freqs = torch.exp( -math.log(max_period) * torch.arange(start=0, end=half, dtype=torch.float32) / half ).to(device=t.device) args = t[:, None].float() * freqs[None] embedding = torch.cat([torch.cos(args), torch.sin(args)], dim=-1) if dim % 2: embedding = torch.cat([embedding, torch.zeros_like(embedding[:, :1])], dim=-1) return embedding def forward(self, t): t_freq = self.timestep_embedding(t, self.frequency_embedding_size).to(next(self.mlp.parameters()).dtype) t_emb = self.mlp(t_freq) return t_emb class ActionEmbedder(nn.Module): def __init__(self, action_size, hidden_size): super().__init__() # self.linear = nn.Linear(action_size, hidden_size) self.projector = nn.Sequential( nn.Linear(action_size, hidden_size, bias=True), nn.GELU(), nn.Linear(hidden_size, hidden_size, bias=True), ) def forward(self, x): # x = self.linear(x) x = self.projector(x) return x class StateEmbedder(nn.Module): def __init__(self, state_size, hidden_size): super().__init__() # self.linear = nn.Linear(action_size, hidden_size) self.projector = nn.Sequential( nn.Linear(2*state_size, 4*hidden_size, bias=True), nn.GELU(), nn.Linear(4*hidden_size, hidden_size, bias=True), nn.GELU(), nn.Linear(hidden_size, hidden_size, bias=True), ) def forward(self, x): # x = self.linear(x) x = self.projector(x) return x class MaskAttention(Attention): def forward( self, x: torch.Tensor, attn_mask: Optional[torch.Tensor] = None, ) -> torch.Tensor: B, N, C = x.shape qkv = self.qkv(x).reshape(B, N, 3, self.num_heads, self.head_dim).permute(2, 0, 3, 1, 4) q, k, v = qkv.unbind(0) q, k = self.q_norm(q), self.k_norm(k) if self.fused_attn: x = F.scaled_dot_product_attention( q, k, v, attn_mask=attn_mask, dropout_p=self.attn_drop.p if self.training else 0., ) else: q = q * self.scale attn = q @ k.transpose(-2, -1) attn = maybe_add_mask(attn, attn_mask) attn = attn.softmax(dim=-1) attn = self.attn_drop(attn) x = attn @ v x = x.transpose(1, 2).reshape(B, N, C) # x = self.norm(x) x = self.proj(x) x = self.proj_drop(x) return x class LabelEmbedder(nn.Module): """ Embeds conditions into vector representations. Also handles label dropout for classifier-free guidance. """ def __init__(self, in_size, hidden_size, dropout_prob=0.1, conditions_shape=(1, 1, 2304)): super().__init__() use_cfg_embedding = dropout_prob > 0 self.linear = nn.Linear(in_size, hidden_size) self.dropout_prob = dropout_prob if dropout_prob > 0: self.uncondition = nn.Parameter(torch.empty(conditions_shape[1:])) def token_drop(self, conditions, force_drop_ids=None): """ Drops conditions to enable classifier-free guidance. """ if force_drop_ids is None: drop_ids = torch.rand(conditions.shape[0], device=conditions.device) < self.dropout_prob else: drop_ids = force_drop_ids == 1 conditions = torch.where(drop_ids.unsqueeze(1).unsqueeze(1).expand(conditions.shape[0], self.uncondition.shape[0], self.uncondition.shape[1]), self.uncondition, conditions) return conditions def forward(self, conditions, train, force_drop_ids=None): use_dropout = self.dropout_prob > 0 if (train and use_dropout) or (force_drop_ids is not None): conditions = self.token_drop(conditions, force_drop_ids) embeddings = self.linear(conditions) return embeddings ################################################################################# # Core DiT Model # ################################################################################# class DiTBlock(nn.Module): """ A DiT block with adaptive layer norm zero (adaLN-Zero) conditioning. """ def __init__(self, hidden_size, num_heads, mlp_ratio=4.0, **block_kwargs): super().__init__() self.norm1 = nn.LayerNorm(hidden_size, elementwise_affine=False, eps=1e-6) self.attn = MaskAttention(hidden_size, num_heads=num_heads, qkv_bias=True, qk_norm=True, norm_layer=RmsNorm, **block_kwargs) # self.attn = Attention(hidden_size, num_heads=num_heads, qkv_bias=True, qk_norm=True, norm_layer=RmsNorm, **block_kwargs) self.norm2 = nn.LayerNorm(hidden_size, elementwise_affine=False, eps=1e-6) mlp_hidden_dim = int(hidden_size * mlp_ratio) approx_gelu = lambda: nn.GELU(approximate="tanh") self.mlp = Mlp(in_features=hidden_size, hidden_features=mlp_hidden_dim, act_layer=approx_gelu, drop=0) self.adaLN_modulation = nn.Sequential( nn.SiLU(), nn.Linear(hidden_size, 6 * hidden_size, bias=True) ) def forward(self, x, c): shift_msa, scale_msa, gate_msa, shift_mlp, scale_mlp, gate_mlp = self.adaLN_modulation(c).chunk(6, dim=1) seq_len = x.shape[1] causal_mask = torch.triu( torch.ones(seq_len, seq_len, device=x.device, dtype=torch.float32), 1 ) causal_mask = causal_mask.masked_fill(causal_mask == 1, float("-inf")) x = x + gate_msa.unsqueeze(1) * self.attn(modulate(self.norm1(x), shift_msa, scale_msa), attn_mask=causal_mask) x = x + gate_mlp.unsqueeze(1) * self.mlp(modulate(self.norm2(x), shift_mlp, scale_mlp)) # x = x + self.attn(self.norm1(x)) # x = x + self.mlp(self.norm2(x)) return x class FinalLayer(nn.Module): """ The final layer of DiT. """ def __init__(self, hidden_size, out_channels): super().__init__() self.norm_final = nn.LayerNorm(hidden_size, elementwise_affine=False, eps=1e-6) self.linear = nn.Linear(hidden_size, out_channels, bias=True) self.adaLN_modulation = nn.Sequential( nn.SiLU(), nn.Linear(hidden_size, 2 * hidden_size, bias=True) ) def forward(self, x, c): shift, scale = self.adaLN_modulation(c).chunk(2, dim=1) x = modulate(self.norm_final(x), shift, scale) x = self.linear(x) return x class DiT(nn.Module): """ Diffusion model with a Transformer backbone. """ def __init__( self, action_dim=192, hidden_size=1152, depth=28, num_heads=16, mlp_ratio=4.0, class_dropout_prob=0.1, token_size=4096, future_action_window_size=1, past_action_window_size=0, learn_sigma=True, use_state=None, state_dim=212, ): super().__init__() self.learn_sigma = learn_sigma self.in_channels = action_dim * 2 self.out_channels = action_dim * 2 if learn_sigma else action_dim self.class_dropout_prob = class_dropout_prob self.num_heads = num_heads self.past_action_window_size = past_action_window_size self.future_action_window_size = future_action_window_size self.use_state = use_state self.x_embedder = ActionEmbedder(action_size=self.in_channels, hidden_size=hidden_size) self.t_embedder = TimestepEmbedder(hidden_size) self.z_embedder = LabelEmbedder(in_size=token_size, hidden_size=hidden_size, dropout_prob=class_dropout_prob, conditions_shape=(1, 1, token_size)) if self.use_state is not None and self.use_state == 'DiT': self.state_embedder = StateEmbedder(state_size=state_dim, hidden_size=hidden_size) # num_patches = self.x_embedder.num_patches # # Will use fixed sin-cos embedding: # +1 for the conditional token, and 1 for the current action scale = hidden_size ** -0.5 if self.use_state == 'DiT': self.positional_embedding = nn.Parameter( scale * torch.randn(future_action_window_size + past_action_window_size + 3, hidden_size)) else: self.positional_embedding = nn.Parameter( scale * torch.randn(future_action_window_size + past_action_window_size + 2, hidden_size)) self.blocks = nn.ModuleList([ DiTBlock(hidden_size, num_heads, mlp_ratio=mlp_ratio) for _ in range(depth) ]) self.final_layer = FinalLayer(hidden_size, self.out_channels) self.initialize_weights() def initialize_weights(self): # Initialize transformer layers: def _basic_init(module): if isinstance(module, nn.Linear): torch.nn.init.xavier_uniform_(module.weight) if module.bias is not None: nn.init.constant_(module.bias, 0) self.apply(_basic_init) nn.init.normal_(self.x_embedder.projector[0].weight, std=0.02) nn.init.constant_(self.x_embedder.projector[0].bias, 0) nn.init.normal_(self.x_embedder.projector[2].weight, std=0.02) nn.init.constant_(self.x_embedder.projector[2].bias, 0) if self.use_state is not None and self.use_state == 'DiT': nn.init.normal_(self.state_embedder.projector[0].weight, std=0.02) nn.init.constant_(self.state_embedder.projector[0].bias, 0) nn.init.normal_(self.state_embedder.projector[2].weight, std=0.02) nn.init.constant_(self.state_embedder.projector[2].bias, 0) nn.init.normal_(self.state_embedder.projector[4].weight, std=0.02) nn.init.constant_(self.state_embedder.projector[4].bias, 0) # Initialize label embedding table: if self.class_dropout_prob > 0: nn.init.normal_(self.z_embedder.uncondition, std=0.02) nn.init.normal_(self.z_embedder.linear.weight, std=0.02) nn.init.constant_(self.z_embedder.linear.bias, 0) # Initialize timestep embedding MLP: nn.init.normal_(self.t_embedder.mlp[0].weight, std=0.02) nn.init.normal_(self.t_embedder.mlp[2].weight, std=0.02) # # Zero-out adaLN modulation layers in DiT blocks: for block in self.blocks: nn.init.constant_(block.adaLN_modulation[-1].weight, 0) nn.init.constant_(block.adaLN_modulation[-1].bias, 0) # Zero-out output layers: nn.init.constant_(self.final_layer.adaLN_modulation[-1].weight, 0) nn.init.constant_(self.final_layer.adaLN_modulation[-1].bias, 0) nn.init.constant_(self.final_layer.linear.weight, 0) nn.init.constant_(self.final_layer.linear.bias, 0) def forward(self, x, t, z, x_mask, state=None, state_mask=None): """ Forward pass of DiT. history: (N, H, D) tensor of action history # not used now x: (N, T, D) tensor of predicting action inputs t: (N,) tensor of diffusion timesteps z: (N, 1, D) tensor of conditions x_mask: (N, T, D) tensor of action masks state: (N, 1, D) tensor of current state state_mask: (N, 1, D) tensor of current state masks """ # concatenate action mask x = x * x_mask x = torch.cat([x, x_mask], dim=2) # [B, T, D] if self.use_state is not None and self.use_state == 'DiT': state = state * state_mask s = torch.cat([state, state_mask.to(state.dtype)], dim=-1) s = self.state_embedder(s) # (N, 1, D) x = self.x_embedder(x) # (N, T, D) t = self.t_embedder(t) # (N, D) z = self.z_embedder(z, self.training) # (N, 1, D) # t.unsqueeze(1) c = z.squeeze(1) + t # (N, 1, D) if self.use_state is not None and self.use_state == 'DiT': x = torch.cat((z, s, x), dim=1) # (N, T+2, D) else: x = torch.cat((z, x), dim=1) x = x + self.positional_embedding # (N, T, D) for block in self.blocks: x = block(x, c) # (N, T+2, D) x = self.final_layer(x, c) # (N, T+2, out_channels) return x[:,-(self.future_action_window_size+1):,:] #[B, T, C] def forward_with_cfg(self, x, t, z, x_mask, cfg_scale, state=None, state_mask=None): """ Forward pass of Diffusion, but also batches the unconditional forward pass for classifier-free guidance. """ # https://github.com/openai/glide-text2im/blob/main/notebooks/text2im.ipynb half = x[: len(x) // 2] combined_x = torch.cat([half, half], dim=0).to(next(self.x_embedder.parameters()).dtype) x_mask = torch.cat([x_mask, x_mask], dim=0).to(next(self.x_embedder.parameters()).dtype) if self.use_state == 'DiT' and state is not None: state = torch.cat([state, state], dim=0) state_mask = torch.cat([state_mask, state_mask], dim=0) model_out = self.forward(combined_x, t, z, x_mask, state, state_mask) else: model_out = self.forward(combined_x, t, z, x_mask) eps, rest = model_out[:, :, :self.out_channels], model_out[:, :, self.out_channels:] cond_eps, uncond_eps = torch.split(eps, len(eps) // 2, dim=0) half_eps = uncond_eps + cfg_scale * (cond_eps - uncond_eps) eps = torch.cat([half_eps, half_eps], dim=0) return torch.cat([eps, rest], dim=2) ################################################################################# # Sine/Cosine Positional Embedding Functions # ################################################################################# # https://github.com/facebookresearch/mae/blob/main/util/pos_embed.py def get_2d_sincos_pos_embed(embed_dim, grid_size, cls_token=False, extra_tokens=0): """ grid_size: int of the grid height and width return: pos_embed: [grid_size*grid_size, embed_dim] or [1+grid_size*grid_size, embed_dim] (w/ or w/o cls_token) """ grid_h = np.arange(grid_size, dtype=np.float32) grid_w = np.arange(grid_size, dtype=np.float32) grid = np.meshgrid(grid_w, grid_h) # here w goes first grid = np.stack(grid, axis=0) grid = grid.reshape([2, 1, grid_size, grid_size]) pos_embed = get_2d_sincos_pos_embed_from_grid(embed_dim, grid) if cls_token and extra_tokens > 0: pos_embed = np.concatenate([np.zeros([extra_tokens, embed_dim]), pos_embed], axis=0) return pos_embed def get_2d_sincos_pos_embed_from_grid(embed_dim, grid): assert embed_dim % 2 == 0 # use half of dimensions to encode grid_h emb_h = get_1d_sincos_pos_embed_from_grid(embed_dim // 2, grid[0]) # (H*W, D/2) emb_w = get_1d_sincos_pos_embed_from_grid(embed_dim // 2, grid[1]) # (H*W, D/2) emb = np.concatenate([emb_h, emb_w], axis=1) # (H*W, D) return emb def get_1d_sincos_pos_embed_from_grid(embed_dim, pos): """ embed_dim: output dimension for each position pos: a list of positions to be encoded: size (M,) out: (M, D) """ assert embed_dim % 2 == 0 omega = np.arange(embed_dim // 2, dtype=np.float64) omega /= embed_dim / 2. omega = 1. / 10000**omega # (D/2,) pos = pos.reshape(-1) # (M,) out = np.einsum('m,d->md', pos, omega) # (M, D/2), outer product emb_sin = np.sin(out) # (M, D/2) emb_cos = np.cos(out) # (M, D/2) emb = np.concatenate([emb_sin, emb_cos], axis=1) # (M, D) return emb