【Pytroch】Transformer实现、einsum函数

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einusm

【参考:一个函数打天下,einsum - 知乎


【参考:Machine-Learning-Collection/transformer_from_scratch.py at master · aladdinpersson/Machine-Learning-Collection

  		energy = torch.einsum("nqhd,nkhd->nhqk", [queries, keys])
        # queries shape: (N, query_len, heads, heads_dim),
        # keys shape: (N, key_len, heads, heads_dim)
        # energy: (N, heads, query_len, key_len)

理解

nqhd:nh,qd 
# nh理解为立方体个数和立方体高度
# qd理解为矩形长度和宽度

nkhd:nh,kd


# 把高维的先提取出来,再对低维的数据进行操作
[nh] qd*(kd)^T = nh qk

Transformer

【参考:Pytorch Transformers from Scratch (Attention is all you need) - YouTube
【参考:Machine-Learning-Collection/transformer_from_scratch.py at master · aladdinpersson/Machine-Learning-Collection

  • TransformerBlock
    在这里插入图片描述

后面没有看懂,学习到了思路就行。

"""
A from scratch implementation of Transformer network,
following the paper Attention is all you need with a
few minor differences. I tried to make it as clear as
possible to understand and also went through the code
on my youtube channel!
"""

import torch
import torch.nn as nn

"""
多头注意力机制
"""


class SelfAttention(nn.Module):
    def __init__(self, embed_size, heads):
        super(SelfAttention, self).__init__()
        self.embed_size = embed_size
        self.heads = heads
        self.head_dim = embed_size // heads

        assert (
                self.head_dim * heads == embed_size
        ), "Embedding size needs to be divisible by heads"

        self.values = nn.Linear(self.head_dim, self.head_dim, bias=False)
        self.keys = nn.Linear(self.head_dim, self.head_dim, bias=False)
        self.queries = nn.Linear(self.head_dim, self.head_dim, bias=False)
        self.fc_out = nn.Linear(heads * self.head_dim, embed_size)

    def forward(self, values, keys, query, mask):
        # Get number of training examples
        N = query.shape[0]

        value_len, key_len, query_len = values.shape[1], keys.shape[1], query.shape[1]

        # Split the embedding into self.heads different pieces
        values = values.reshape(N, value_len, self.heads, self.head_dim)
        keys = keys.reshape(N, key_len, self.heads, self.head_dim)
        query = query.reshape(N, query_len, self.heads, self.head_dim)

        values = self.values(values)  # (N, value_len, heads, head_dim)
        keys = self.keys(keys)  # (N, key_len, heads, head_dim)
        queries = self.queries(query)  # (N, query_len, heads, heads_dim)

        # Einsum does matrix mult. for query*keys for each training example
        # with every other training example, don't be confused by einsum
        # it's just how I like doing matrix multiplication & bmm

        energy = torch.einsum("nqhd,nkhd->nhqk", [queries, keys])
        # queries shape: (N, query_len, heads, heads_dim),
        # keys shape: (N, key_len, heads, heads_dim)
        # energy: (N, heads, query_len, key_len)

        # Mask padded indices so their weights become 0
        # decoder 需要先用遮挡矩阵遮住每一个单词之后的信息
        if mask is not None:
            energy = energy.masked_fill(mask == 0, float("-1e20"))

        # Normalize energy values similarly to seq2seq + attention
        # so that they sum to 1. Also divide by scaling factor for
        # better stability
        attention = torch.softmax(energy / (self.embed_size ** (1 / 2)), dim=3)  # 对最后一个维度(每一行)进行softmax
        # attention shape: (N, heads, query_len, key_len)

        out = torch.einsum("nhql,nlhd->nqhd", [attention, values]).reshape(
            N, query_len, self.heads * self.head_dim
        )
        # attention shape: (N, heads, query_len, key_len)
        # values shape: (N, value_len, heads, heads_dim)
        # out after matrix multiply: (N, query_len, heads, head_dim), then
        # we reshape and flatten the last two dimensions.

        out = self.fc_out(out)
        # Linear layer doesn't modify the shape, final shape will be
        # (N, query_len, embed_size)

        return out


class TransformerBlock(nn.Module):
    def __init__(self, embed_size, heads, dropout, forward_expansion):
        super(TransformerBlock, self).__init__()
        self.attention = SelfAttention(embed_size, heads)
        self.norm1 = nn.LayerNorm(embed_size)
        self.norm2 = nn.LayerNorm(embed_size)

        # 先将维度提升forward_expansion倍,经过relu激活函数,又将维度降回来
        self.feed_forward = nn.Sequential(
            nn.Linear(embed_size, forward_expansion * embed_size),
            nn.ReLU(),
            nn.Linear(forward_expansion * embed_size, embed_size),
        )

        self.dropout = nn.Dropout(dropout)

    def forward(self, value, key, query, mask):
        attention = self.attention(value, key, query, mask)

        # Add skip connection, run through normalization and finally dropout
        x = self.dropout(self.norm1(attention + query))
        forward = self.feed_forward(x)
        out = self.dropout(self.norm2(forward + x))
        return out


class Encoder(nn.Module):
    def __init__(
            self,
            src_vocab_size,
            embed_size,
            num_layers,
            heads,
            device,
            forward_expansion,
            dropout,
            max_length,
    ):
        super(Encoder, self).__init__()
        self.embed_size = embed_size
        self.device = device
        self.word_embedding = nn.Embedding(src_vocab_size, embed_size)
        self.position_embedding = nn.Embedding(max_length, embed_size)

        self.layers = nn.ModuleList(
            [
                TransformerBlock(
                    embed_size,
                    heads,
                    dropout=dropout,
                    forward_expansion=forward_expansion,
                )
                for _ in range(num_layers)
            ]
        )

        self.dropout = nn.Dropout(dropout)

    def forward(self, x, mask):
        N, seq_length = x.shape
        positions = torch.arange(0, seq_length).expand(N, seq_length).to(self.device)
        out = self.dropout(
            (self.word_embedding(x) + self.position_embedding(positions))
        )

        # In the Encoder the query, key, value are all the same, it's in the
        # decoder this will change. This might look a bit odd in this case.
        for layer in self.layers:
            out = layer(out, out, out, mask)

        return out


class DecoderBlock(nn.Module):
    def __init__(self, embed_size, heads, forward_expansion, dropout, device):
        super(DecoderBlock, self).__init__()
        self.norm = nn.LayerNorm(embed_size)
        self.attention = SelfAttention(embed_size, heads=heads)
        self.transformer_block = TransformerBlock(
            embed_size, heads, dropout, forward_expansion
        )
        self.dropout = nn.Dropout(dropout)

    def forward(self, x, value, key, src_mask, trg_mask):
        attention = self.attention(x, x, x, trg_mask)
        query = self.dropout(self.norm(attention + x))
        out = self.transformer_block(value, key, query, src_mask)
        return out


class Decoder(nn.Module):
    def __init__(
            self,
            trg_vocab_size,
            embed_size,
            num_layers,
            heads,
            forward_expansion,
            dropout,
            device,
            max_length,
    ):
        super(Decoder, self).__init__()
        self.device = device
        self.word_embedding = nn.Embedding(trg_vocab_size, embed_size)  # 词向量
        self.position_embedding = nn.Embedding(max_length, embed_size)  # 位置向量

        self.layers = nn.ModuleList(
            [
                DecoderBlock(embed_size, heads, forward_expansion, dropout, device)
                for _ in range(num_layers)
            ]
        )
        self.fc_out = nn.Linear(embed_size, trg_vocab_size)
        self.dropout = nn.Dropout(dropout)

    def forward(self, x, enc_out, src_mask, trg_mask):
        N, seq_length = x.shape
        positions = torch.arange(0, seq_length).expand(N, seq_length).to(self.device)
        x = self.dropout((self.word_embedding(x) + self.position_embedding(positions)))

        for layer in self.layers:
            x = layer(x, enc_out, enc_out, src_mask, trg_mask)

        out = self.fc_out(x)

        return out


class Transformer(nn.Module):
    def __init__(
            self,
            src_vocab_size,
            trg_vocab_size,
            src_pad_idx,
            trg_pad_idx,
            embed_size=512,
            num_layers=6,
            forward_expansion=4,
            heads=8,
            dropout=0,
            device="cpu",
            max_length=100,
    ):
        super(Transformer, self).__init__()

        self.encoder = Encoder(
            src_vocab_size,
            embed_size,
            num_layers,
            heads,
            device,
            forward_expansion,
            dropout,
            max_length,
        )

        self.decoder = Decoder(
            trg_vocab_size,
            embed_size,
            num_layers,
            heads,
            forward_expansion,
            dropout,
            device,
            max_length,
        )

        self.src_pad_idx = src_pad_idx
        self.trg_pad_idx = trg_pad_idx
        self.device = device

    def make_src_mask(self, src):
        src_mask = (src != self.src_pad_idx).unsqueeze(1).unsqueeze(2)
        # (N, 1, 1, src_len) 
        return src_mask.to(self.device)

    def make_trg_mask(self, trg):
        N, trg_len = trg.shape
        trg_mask = torch.tril(torch.ones((trg_len, trg_len))).expand(
            N, 1, trg_len, trg_len
        )

        return trg_mask.to(self.device)

    def forward(self, src, trg):
        src_mask = self.make_src_mask(src)
        trg_mask = self.make_trg_mask(trg)
        enc_src = self.encoder(src, src_mask)
        out = self.decoder(trg, enc_src, src_mask, trg_mask)
        return out


if __name__ == "__main__":
    device = torch.device("cuda" if torch.cuda.is_available() else "cpu")
    print(device)

    x = torch.tensor([[1, 5, 6, 4, 3, 9, 5, 2, 0], [1, 8, 7, 3, 4, 5, 6, 7, 2]]).to(
        device
    )
    trg = torch.tensor([[1, 7, 4, 3, 5, 9, 2, 0], [1, 5, 6, 2, 4, 7, 6, 2]]).to(device)

    src_pad_idx = 0
    trg_pad_idx = 0
    src_vocab_size = 10
    trg_vocab_size = 10
    model = Transformer(src_vocab_size, trg_vocab_size, src_pad_idx, trg_pad_idx, device=device).to(
        device
    )
    out = model(x, trg[:, :-1])
    print(out.shape)

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以下是使用PyTorch实现self-attention的代码: ``` import torch import torch.nn as nn class SelfAttention(nn.Module): def __init__(self, embed_size, heads): super(SelfAttention, self).__init__() self.embed_size = embed_size self.heads = heads self.head_dim = embed_size // heads assert (self.head_dim * heads == embed_size), "Embed size needs to be divisible by heads" self.values = nn.Linear(self.head_dim, self.head_dim, bias=False) self.keys = nn.Linear(self.head_dim, self.head_dim, bias=False) self.queries = nn.Linear(self.head_dim, self.head_dim, bias=False) self.fc_out = nn.Linear(heads*self.head_dim, embed_size) def forward(self, values, keys, query, mask): # Get number of training examples N = query.shape[0] # Split embedding into self.heads pieces values = values.reshape(N, -1, self.heads, self.head_dim) keys = keys.reshape(N, -1, self.heads, self.head_dim) query = query.reshape(N, -1, self.heads, self.head_dim) # Compute the energy between queries and keys for each head energy = torch.einsum("nqhd,nkhd->nhqk", [query, keys]) # Add the mask to the energy (if present) if mask is not None: energy = energy.masked_fill(mask == 0, float("-1e20")) # Apply softmax to get attention scores attention = torch.softmax(energy / (self.embed_size ** (1/2)), dim=3) # Compute the weighted average of the values out = torch.einsum("nhql,nlhd->nqhd", [attention, values]).reshape( N, -1, self.heads*self.head_dim ) # Apply output fully connected layer out = self.fc_out(out) return out ``` 这是一个名为`SelfAttention`的PyTorch模块,它实现了self-attention的前向传递。在`__init__`函数中,我们定义了值、键和查询矩阵的线性层。在`forward`函数中,我们首先将输入张量分为self.heads个头,然后计算每个头的能量。接下来,我们应用softmax函数来获取注意力分数,并计算加权平均值。最后,我们将输出送入一个全连接层,以获得最终的self-attention表示。

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