《動手學深度學習》Pytorch版學習筆記(二):Task04

課程背景

在疫情的影響下,不少學校已經做出了延遲開學的決定,:伯禹教育Datawhale和鯨科技牽頭與多家AI企業合作,讓在家的同學也能免費學習優質的付費課程,同時爲學習者創建好的學習環境,提供就業綠色通道。

主修課程

《動手學深度學習》 代碼講解Pytorch版:該書是2019年國內最受歡迎的人工智能學習教材之一,是一本面向中文讀者的能運行、可討論的深度學習教科書,書籍作者之一亞馬遜首席科學家李沐,畢業於上海交大。伯禹教育攜手上海交通大學團隊,基於此書籍,將其中的代碼框架由MXNET遷移至PyTorch,並對這些代碼製作了講解視頻。幫助大家邊動手寫代碼邊鞏固理論知識,從原理到實踐,上手深度學習。

1 任務

【第二次打卡】內容(2月15日-17日)
1.Task03:過擬合、欠擬合及其解決方案;梯度消失、梯度爆炸;循環神經網絡進階(1天)
2.Task04:機器翻譯及相關技術;注意力機制與Seq2seq模型;Transformer(1天)
3.Task05:卷積神經網絡基礎;leNet;卷積神經網絡進階(1天)
打卡時間:【2020-02-15 08:00 -- 2020-02-17 22:00】
打卡鏈接:學習開始放出

2 機器翻譯及相關技術

機器翻譯(MT):將一段文本從一種語言自動翻譯爲另一種語言,用神經網絡解決這個問題通常稱爲神經機器翻譯(NMT)。
主要特徵:輸出是單詞序列而不是單個單詞。 輸出序列的長度可能與源序列的長度不同。

#導入包
import os
os.listdir('/home/kesci/input/')

import sys
sys.path.append('/home/kesci/input/d2l9528/')
import collections
import d2l
import zipfile
from d2l.data.base import Vocab
import time
import torch
import torch.nn as nn
import torch.nn.functional as F
from torch.utils import data
from torch import optim

#數據預處理:將數據集清洗、轉化爲神經網絡的輸入minbatch
with open('/home/kesci/input/fraeng6506/fra.txt', 'r') as f:
      raw_text = f.read()
print(raw_text[0:1000])

def preprocess_raw(text):
    text = text.replace('\u202f', ' ').replace('\xa0', ' ')
    out = ''
    for i, char in enumerate(text.lower()):
        if char in (',', '!', '.') and i > 0 and text[i-1] != ' ':
            out += ' '
        out += char
    return out

text = preprocess_raw(raw_text)
print(text[0:1000])

#分詞:字符串---單詞組成的列表
num_examples = 50000
source, target = [], []
for i, line in enumerate(text.split('\n')):
    if i > num_examples:
        break
    parts = line.split('\t')
    if len(parts) >= 2:
        source.append(parts[0].split(' '))
        target.append(parts[1].split(' '))
        
source[0:3], target[0:3]

d2l.set_figsize()
d2l.plt.hist([[len(l) for l in source], [len(l) for l in target]],label=['source', 'target'])
d2l.plt.legend(loc='upper right');

#建立詞典:單詞組成的列表---單詞id組成的列表
def build_vocab(tokens):
    tokens = [token for line in tokens for token in line]
    return d2l.data.base.Vocab(tokens, min_freq=3, use_special_tokens=True)

src_vocab = build_vocab(source)
len(src_vocab)

#載入數據集
def pad(line, max_len, padding_token):
    if len(line) > max_len:
        return line[:max_len]
    return line + [padding_token] * (max_len - len(line))
pad(src_vocab[source[0]], 10, src_vocab.pad)

def build_array(lines, vocab, max_len, is_source):
    lines = [vocab[line] for line in lines]
    if not is_source:
        lines = [[vocab.bos] + line + [vocab.eos] for line in lines]
    array = torch.tensor([pad(line, max_len, vocab.pad) for line in lines])
    valid_len = (array != vocab.pad).sum(1) #第一個維度
    return array, valid_len
def load_data_nmt(batch_size, max_len): # This function is saved in d2l.
    src_vocab, tgt_vocab = build_vocab(source), build_vocab(target)
    src_array, src_valid_len = build_array(source, src_vocab, max_len, True)
    tgt_array, tgt_valid_len = build_array(target, tgt_vocab, max_len, False)
    train_data = data.TensorDataset(src_array, src_valid_len, tgt_array, tgt_valid_len)
    train_iter = data.DataLoader(train_data, batch_size, shuffle=True)
    return src_vocab, tgt_vocab, train_iter

src_vocab, tgt_vocab, train_iter = load_data_nmt(batch_size=2, max_len=8)
for X, X_valid_len, Y, Y_valid_len, in train_iter:
    print('X =', X.type(torch.int32), '\nValid lengths for X =', X_valid_len,
        '\nY =', Y.type(torch.int32), '\nValid lengths for Y =', Y_valid_len)
    break

#Encoder-Decoder:encoder:輸入到隱藏狀態 ;decoder:隱藏狀態到輸出
class Encoder(nn.Module):
    def __init__(self, **kwargs):
        super(Encoder, self).__init__(**kwargs)

    def forward(self, X, *args):
        raise NotImplementedError

class Decoder(nn.Module):
    def __init__(self, **kwargs):
        super(Decoder, self).__init__(**kwargs)

    def init_state(self, enc_outputs, *args):
        raise NotImplementedError

    def forward(self, X, state):
        raise NotImplementedError

class EncoderDecoder(nn.Module):
    def __init__(self, encoder, decoder, **kwargs):
        super(EncoderDecoder, self).__init__(**kwargs)
        self.encoder = encoder
        self.decoder = decoder

    def forward(self, enc_X, dec_X, *args):
        enc_outputs = self.encoder(enc_X, *args)
        dec_state = self.decoder.init_state(enc_outputs, *args)
        return self.decoder(dec_X, dec_state)

Sequence to Sequence模型

#Encoder
class Seq2SeqEncoder(d2l.Encoder):
    def __init__(self, vocab_size, embed_size, num_hiddens, num_layers,
                 dropout=0, **kwargs):
        super(Seq2SeqEncoder, self).__init__(**kwargs)
        self.num_hiddens=num_hiddens
        self.num_layers=num_layers
        self.embedding = nn.Embedding(vocab_size, embed_size)
        self.rnn = nn.LSTM(embed_size,num_hiddens, num_layers, dropout=dropout)
   
    def begin_state(self, batch_size, device):
        return [torch.zeros(size=(self.num_layers, batch_size, self.num_hiddens),  device=device),
                torch.zeros(size=(self.num_layers, batch_size, self.num_hiddens),  device=device)]
    def forward(self, X, *args):
        X = self.embedding(X) # X shape: (batch_size, seq_len, embed_size)
        X = X.transpose(0, 1)  # RNN needs first axes to be time
        # state = self.begin_state(X.shape[1], device=X.device)
        out, state = self.rnn(X)
        # The shape of out is (seq_len, batch_size, num_hiddens).
        # state contains the hidden state and the memory cell
        # of the last time step, the shape is (num_layers, batch_size, num_hiddens)
        return out, state

encoder = Seq2SeqEncoder(vocab_size=10, embed_size=8,num_hiddens=16, num_layers=2)
X = torch.zeros((4, 7),dtype=torch.long)
output, state = encoder(X)
output.shape, len(state), state[0].shape, state[1].shape

#Decoder
class Seq2SeqDecoder(d2l.Decoder):
    def __init__(self, vocab_size, embed_size, num_hiddens, num_layers,
                 dropout=0, **kwargs):
        super(Seq2SeqDecoder, self).__init__(**kwargs)
        self.embedding = nn.Embedding(vocab_size, embed_size)
        self.rnn = nn.LSTM(embed_size,num_hiddens, num_layers, dropout=dropout)
        self.dense = nn.Linear(num_hiddens,vocab_size)

    def init_state(self, enc_outputs, *args):
        return enc_outputs[1]

    def forward(self, X, state):
        X = self.embedding(X).transpose(0, 1)
        out, state = self.rnn(X, state)
        # Make the batch to be the first dimension to simplify loss computation.
        out = self.dense(out).transpose(0, 1)
        return out, state
decoder = Seq2SeqDecoder(vocab_size=10, embed_size=8,num_hiddens=16, num_layers=2)
state = decoder.init_state(encoder(X))
out, state = decoder(X, state)
out.shape, len(state), state[0].shape, state[1].shape

#損失函數
def SequenceMask(X, X_len,value=0):
    maxlen = X.size(1)
    mask = torch.arange(maxlen)[None, :].to(X_len.device) < X_len[:, None]   
    X[~mask]=value
    return X
    
class MaskedSoftmaxCELoss(nn.CrossEntropyLoss):
    # pred shape: (batch_size, seq_len, vocab_size)
    # label shape: (batch_size, seq_len)
    # valid_length shape: (batch_size, )
    def forward(self, pred, label, valid_length):
        # the sample weights shape should be (batch_size, seq_len)
        weights = torch.ones_like(label)
        weights = SequenceMask(weights, valid_length).float()
        self.reduction='none'
        output=super(MaskedSoftmaxCELoss, self).forward(pred.transpose(1,2), label)
        return (output*weights).mean(dim=1)

#訓練
def train_ch7(model, data_iter, lr, num_epochs, device):  # Saved in d2l
    model.to(device)
    optimizer = optim.Adam(model.parameters(), lr=lr)
    loss = MaskedSoftmaxCELoss()
    tic = time.time()
    for epoch in range(1, num_epochs+1):
        l_sum, num_tokens_sum = 0.0, 0.0
        for batch in data_iter:
            optimizer.zero_grad()
            X, X_vlen, Y, Y_vlen = [x.to(device) for x in batch]
            Y_input, Y_label, Y_vlen = Y[:,:-1], Y[:,1:], Y_vlen-1
            
            Y_hat, _ = model(X, Y_input, X_vlen, Y_vlen)
            l = loss(Y_hat, Y_label, Y_vlen).sum()
            l.backward()

            with torch.no_grad():
                d2l.grad_clipping_nn(model, 5, device)
            num_tokens = Y_vlen.sum().item()
            optimizer.step()
            l_sum += l.sum().item()
            num_tokens_sum += num_tokens
        if epoch % 50 == 0:
            print("epoch {0:4d},loss {1:.3f}, time {2:.1f} sec".format( 
                  epoch, (l_sum/num_tokens_sum), time.time()-tic))
            tic = time.time()

embed_size, num_hiddens, num_layers, dropout = 32, 32, 2, 0.0
batch_size, num_examples, max_len = 64, 1e3, 10
lr, num_epochs, ctx = 0.005, 300, d2l.try_gpu()
src_vocab, tgt_vocab, train_iter = d2l.load_data_nmt(
    batch_size, max_len,num_examples)
encoder = Seq2SeqEncoder(
    len(src_vocab), embed_size, num_hiddens, num_layers, dropout)
decoder = Seq2SeqDecoder(
    len(tgt_vocab), embed_size, num_hiddens, num_layers, dropout)
model = d2l.EncoderDecoder(encoder, decoder)
train_ch7(model, train_iter, lr, num_epochs, ctx)

#測試
def translate_ch7(model, src_sentence, src_vocab, tgt_vocab, max_len, device):
    src_tokens = src_vocab[src_sentence.lower().split(' ')]
    src_len = len(src_tokens)
    if src_len < max_len:
        src_tokens += [src_vocab.pad] * (max_len - src_len)
    enc_X = torch.tensor(src_tokens, device=device)
    enc_valid_length = torch.tensor([src_len], device=device)
    # use expand_dim to add the batch_size dimension.
    enc_outputs = model.encoder(enc_X.unsqueeze(dim=0), enc_valid_length)
    dec_state = model.decoder.init_state(enc_outputs, enc_valid_length)
    dec_X = torch.tensor([tgt_vocab.bos], device=device).unsqueeze(dim=0)
    predict_tokens = []
    for _ in range(max_len):
        Y, dec_state = model.decoder(dec_X, dec_state)
        # The token with highest score is used as the next time step input.
        dec_X = Y.argmax(dim=2)
        py = dec_X.squeeze(dim=0).int().item()
        if py == tgt_vocab.eos:
            break
        predict_tokens.append(py)
    return ' '.join(tgt_vocab.to_tokens(predict_tokens))

for sentence in ['Go .', 'Wow !', "I'm OK .", 'I won !']:
    print(sentence + ' => ' + translate_ch7(
        model, sentence, src_vocab, tgt_vocab, max_len, ctx))

3 注意力機制與Seq2seq模型

3.1 注意力機制

在“編碼器—解碼器(seq2seq)”⼀節⾥,解碼器在各個時間步依賴相同的背景變量(context vector)來獲取輸⼊序列信息。當編碼器爲循環神經⽹絡時,背景變量來⾃它最終時間步的隱藏狀態。將源序列輸入信息以循環單位狀態編碼,然後將其傳遞給解碼器以生成目標序列。然而這種結構存在着問題,尤其是RNN機制實際中存在長程梯度消失的問題,對於較長的句子,我們很難寄希望於將輸入的序列轉化爲定長的向量而保存所有的有效信息,所以隨着所需翻譯句子的長度的增加,這種結構的效果會顯著下降。

與此同時,解碼的目標詞語可能只與原輸入的部分詞語有關,而並不是與所有的輸入有關。例如,當把“Hello world”翻譯成“Bonjour le monde”時,“Hello”映射成“Bonjour”,“world”映射成“monde”。在seq2seq模型中,解碼器只能隱式地從編碼器的最終狀態中選擇相應的信息。然而,注意力機制可以將這種選擇過程顯式地建模。

3.2 注意力機制框架

Attention 是一種通用的帶權池化方法,輸入由兩部分構成:詢問(query)和鍵值對(key-value pairs)。 ki∈Rdk,vi∈Rdv . Query q∈Rdq , attention layer得到輸出與value的維度一致 o∈Rdv . 對於一個query來說,attention layer 會與每一個key計算注意力分數並進行權重的歸一化,輸出的向量 o 則是value的加權求和,而每個key計算的權重與value一一對應。

3.3 引入注意力機制的Seq2seq模型

本節中將注意機制添加到sequence to sequence 模型中,以顯式地使用權重聚合states。下圖展示encoding 和decoding的模型結構,在時間步爲t的時候。此刻attention layer保存着encodering看到的所有信息——即encoding的每一步輸出。在decoding階段,解碼器的 t 時刻的隱藏狀態被當作query,encoder的每個時間步的hidden states作爲key和value進行attention聚合. Attetion model的輸出當作成上下文信息context vector,並與解碼器輸入 Dt 拼接起來一起送到解碼器。

3.4 解碼器

在解碼的每個時間步,我們使用解碼器的最後一個RNN層的輸出作爲注意層的query。然後,將注意力模型的輸出與輸入嵌入向量連接起來,輸入到RNN層。雖然RNN層隱藏狀態也包含來自解碼器的歷史信息,但是attention model的輸出顯式地選擇了enc_valid_len以內的編碼器輸出,這樣attention機制就會盡可能排除其他不相關的信息。

class Seq2SeqAttentionDecoder(d2l.Decoder):
    def __init__(self, vocab_size, embed_size, num_hiddens, num_layers,
                 dropout=0, **kwargs):
        super(Seq2SeqAttentionDecoder, self).__init__(**kwargs)
        self.attention_cell = MLPAttention(num_hiddens,num_hiddens, dropout)
        self.embedding = nn.Embedding(vocab_size, embed_size)
        self.rnn = nn.LSTM(embed_size+ num_hiddens,num_hiddens, num_layers, dropout=dropout)
        self.dense = nn.Linear(num_hiddens,vocab_size)

    def init_state(self, enc_outputs, enc_valid_len, *args):
        outputs, hidden_state = enc_outputs
#         print("first:",outputs.size(),hidden_state[0].size(),hidden_state[1].size())
        # Transpose outputs to (batch_size, seq_len, hidden_size)
        return (outputs.permute(1,0,-1), hidden_state, enc_valid_len)
        #outputs.swapaxes(0, 1)
        
    def forward(self, X, state):
        enc_outputs, hidden_state, enc_valid_len = state
        #("X.size",X.size())
        X = self.embedding(X).transpose(0,1)
#         print("Xembeding.size2",X.size())
        outputs = []
        for l, x in enumerate(X):
#             print(f"\n{l}-th token")
#             print("x.first.size()",x.size())
            # query shape: (batch_size, 1, hidden_size)
            # select hidden state of the last rnn layer as query
            query = hidden_state[0][-1].unsqueeze(1) # np.expand_dims(hidden_state[0][-1], axis=1)
            # context has same shape as query
#             print("query enc_outputs, enc_outputs:\n",query.size(), enc_outputs.size(), enc_outputs.size())
            context = self.attention_cell(query, enc_outputs, enc_outputs, enc_valid_len)
            # Concatenate on the feature dimension
#             print("context.size:",context.size())
            x = torch.cat((context, x.unsqueeze(1)), dim=-1)
            # Reshape x to (1, batch_size, embed_size+hidden_size)
#             print("rnn",x.size(), len(hidden_state))
            out, hidden_state = self.rnn(x.transpose(0,1), hidden_state)
            outputs.append(out)
        outputs = self.dense(torch.cat(outputs, dim=0))
        return outputs.transpose(0, 1), [enc_outputs, hidden_state,
                                        enc_valid_len]

現在我們可以用注意力模型來測試seq2seq。爲了與第9.7節中的模型保持一致,我們對vocab_size、embed_size、num_hiddens和num_layers使用相同的超參數。結果,我們得到了相同的解碼器輸出形狀,但是狀態結構改變了。

encoder = d2l.Seq2SeqEncoder(vocab_size=10, embed_size=8,
                            num_hiddens=16, num_layers=2)
# encoder.initialize()
decoder = Seq2SeqAttentionDecoder(vocab_size=10, embed_size=8,
                                  num_hiddens=16, num_layers=2)
X = torch.zeros((4, 7),dtype=torch.long)
print("batch size=4\nseq_length=7\nhidden dim=16\nnum_layers=2\n")
print('encoder output size:', encoder(X)[0].size())
print('encoder hidden size:', encoder(X)[1][0].size())
print('encoder memory size:', encoder(X)[1][1].size())
state = decoder.init_state(encoder(X), None)
out, state = decoder(X, state)
out.shape, len(state), state[0].shape, len(state[1]), state[1][0].shape

3.5 訓練

import zipfile
import torch
import requests
from io import BytesIO
from torch.utils import data
import sys
import collections

class Vocab(object): # This class is saved in d2l.
  def __init__(self, tokens, min_freq=0, use_special_tokens=False):
    # sort by frequency and token
    counter = collections.Counter(tokens)
    token_freqs = sorted(counter.items(), key=lambda x: x[0])
    token_freqs.sort(key=lambda x: x[1], reverse=True)
    if use_special_tokens:
      # padding, begin of sentence, end of sentence, unknown
      self.pad, self.bos, self.eos, self.unk = (0, 1, 2, 3)
      tokens = ['', '', '', '']
    else:
      self.unk = 0
      tokens = ['']
    tokens += [token for token, freq in token_freqs if freq >= min_freq]
    self.idx_to_token = []
    self.token_to_idx = dict()
    for token in tokens:
      self.idx_to_token.append(token)
      self.token_to_idx[token] = len(self.idx_to_token) - 1
      
  def __len__(self):
    return len(self.idx_to_token)
  
  def __getitem__(self, tokens):
    if not isinstance(tokens, (list, tuple)):
      return self.token_to_idx.get(tokens, self.unk)
    else:
      return [self.__getitem__(token) for token in tokens]
    
  def to_tokens(self, indices):
    if not isinstance(indices, (list, tuple)):
      return self.idx_to_token[indices]
    else:
      return [self.idx_to_token[index] for index in indices]

def load_data_nmt(batch_size, max_len, num_examples=1000):
    """Download an NMT dataset, return its vocabulary and data iterator."""
    # Download and preprocess
    def preprocess_raw(text):
        text = text.replace('\u202f', ' ').replace('\xa0', ' ')
        out = ''
        for i, char in enumerate(text.lower()):
            if char in (',', '!', '.') and text[i-1] != ' ':
                out += ' '
            out += char
        return out 


    with open('/home/kesci/input/fraeng6506/fra.txt', 'r') as f:
      raw_text = f.read()


    text = preprocess_raw(raw_text)

    # Tokenize
    source, target = [], []
    for i, line in enumerate(text.split('\n')):
        if i >= num_examples:
            break
        parts = line.split('\t')
        if len(parts) >= 2:
            source.append(parts[0].split(' '))
            target.append(parts[1].split(' '))

    # Build vocab
    def build_vocab(tokens):
        tokens = [token for line in tokens for token in line]
        return Vocab(tokens, min_freq=3, use_special_tokens=True)
    src_vocab, tgt_vocab = build_vocab(source), build_vocab(target)

    # Convert to index arrays
    def pad(line, max_len, padding_token):
        if len(line) > max_len:
            return line[:max_len]
        return line + [padding_token] * (max_len - len(line))

    def build_array(lines, vocab, max_len, is_source):
        lines = [vocab[line] for line in lines]
        if not is_source:
            lines = [[vocab.bos] + line + [vocab.eos] for line in lines]
        array = torch.tensor([pad(line, max_len, vocab.pad) for line in lines])
        valid_len = (array != vocab.pad).sum(1)
        return array, valid_len

    src_vocab, tgt_vocab = build_vocab(source), build_vocab(target)
    src_array, src_valid_len = build_array(source, src_vocab, max_len, True)
    tgt_array, tgt_valid_len = build_array(target, tgt_vocab, max_len, False)
    train_data = data.TensorDataset(src_array, src_valid_len, tgt_array, tgt_valid_len)
    train_iter = data.DataLoader(train_data, batch_size, shuffle=True)
    return src_vocab, tgt_vocab, train_iter

embed_size, num_hiddens, num_layers, dropout = 32, 32, 2, 0.0
batch_size, num_steps = 64, 10
lr, num_epochs, ctx = 0.005, 500, d2l.try_gpu()

src_vocab, tgt_vocab, train_iter = load_data_nmt(batch_size, num_steps)
encoder = d2l.Seq2SeqEncoder(
    len(src_vocab), embed_size, num_hiddens, num_layers, dropout)
decoder = Seq2SeqAttentionDecoder(
    len(tgt_vocab), embed_size, num_hiddens, num_layers, dropout)
model = d2l.EncoderDecoder(encoder, decoder)

3.6 訓練和預測

d2l.train_s2s_ch9(model, train_iter, lr, num_epochs, ctx)

for sentence in ['Go .', 'Good Night !', "I'm OK .", 'I won !']:
    print(sentence + ' => ' + d2l.predict_s2s_ch9(
        model, sentence, src_vocab, tgt_vocab, num_steps, ctx))

4 Transformer

在之前的章節中,我們已經介紹了主流的神經網絡架構如卷積神經網絡(CNNs)和循環神經網絡(RNNs)。讓我們進行一些回顧:

  1. CNNs 易於並行化,卻不適合捕捉變長序列內的依賴關係。
  2. RNNs 適合捕捉長距離變長序列的依賴,但是卻難以實現並行化處理序列。

爲了整合CNN和RNN的優勢,[Vaswani et al., 2017] 創新性地使用注意力機制設計了Transformer模型。該模型利用attention機制實現了並行化捕捉序列依賴,並且同時處理序列的每個位置的tokens,上述優勢使得Transformer模型在性能優異的同時大大減少了訓練時間。

與seq2seq模型相似,Transformer同樣基於編碼器-解碼器架構,其區別主要在於以下三點:

  1. Transformer blocks:將seq2seq模型重的循環網絡替換爲了Transformer Blocks,該模塊包含一個多頭注意力層(Multi-head Attention Layers)以及兩個position-wise feed-forward networks(FFN)。對於解碼器來說,另一個多頭注意力層被用於接受編碼器的隱藏狀態。
  2. Add and norm:多頭注意力層和前饋網絡的輸出被送到兩個“add and norm”層進行處理,該層包含殘差結構以及層歸一化。
  3. Position encoding:由於自注意力層並沒有區分元素的順序,所以一個位置編碼層被用於向序列元素裏添加位置信息。

在接下來的部分,我們將會帶領大家實現Transformer裏全新的子結構,並且構建一個神經機器翻譯模型用以訓練和測試。

import os
import math
import numpy as np
import torch 
import torch.nn as nn
import torch.nn.functional as F
import sys
sys.path.append('/home/kesci/input/d2len9900')
import d2l

#masked softmax 實現
def SequenceMask(X, X_len,value=-1e6):
    maxlen = X.size(1)
    X_len = X_len.to(X.device)
    #print(X.size(),torch.arange((maxlen),dtype=torch.float)[None, :],'\n',X_len[:, None] )
    mask = torch.arange((maxlen), dtype=torch.float, device=X.device)
    mask = mask[None, :] < X_len[:, None]
    #print(mask)
    X[~mask]=value
    return X

def masked_softmax(X, valid_length):
    # X: 3-D tensor, valid_length: 1-D or 2-D tensor
    softmax = nn.Softmax(dim=-1)
    if valid_length is None:
        return softmax(X)
    else:
        shape = X.shape
        if valid_length.dim() == 1:
            try:
                valid_length = torch.FloatTensor(valid_length.numpy().repeat(shape[1], axis=0))#[2,2,3,3]
            except:
                valid_length = torch.FloatTensor(valid_length.cpu().numpy().repeat(shape[1], axis=0))#[2,2,3,3]
        else:
            valid_length = valid_length.reshape((-1,))
        # fill masked elements with a large negative, whose exp is 0
        X = SequenceMask(X.reshape((-1, shape[-1])), valid_length)
 
        return softmax(X).reshape(shape)

# Save to the d2l package.
class DotProductAttention(nn.Module): 
    def __init__(self, dropout, **kwargs):
        super(DotProductAttention, self).__init__(**kwargs)
        self.dropout = nn.Dropout(dropout)

    # query: (batch_size, #queries, d)
    # key: (batch_size, #kv_pairs, d)
    # value: (batch_size, #kv_pairs, dim_v)
    # valid_length: either (batch_size, ) or (batch_size, xx)
    def forward(self, query, key, value, valid_length=None):
        d = query.shape[-1]
        # set transpose_b=True to swap the last two dimensions of key
        scores = torch.bmm(query, key.transpose(1,2)) / math.sqrt(d)
        attention_weights = self.dropout(masked_softmax(scores, valid_length))
        return torch.bmm(attention_weights, value)

4.1 多頭注意力層

class MultiHeadAttention(nn.Module):
    def __init__(self, input_size, hidden_size, num_heads, dropout, **kwargs):
        super(MultiHeadAttention, self).__init__(**kwargs)
        self.num_heads = num_heads
        self.attention = DotProductAttention(dropout)
        self.W_q = nn.Linear(input_size, hidden_size, bias=False)
        self.W_k = nn.Linear(input_size, hidden_size, bias=False)
        self.W_v = nn.Linear(input_size, hidden_size, bias=False)
        self.W_o = nn.Linear(hidden_size, hidden_size, bias=False)
    
    def forward(self, query, key, value, valid_length):
        # query, key, and value shape: (batch_size, seq_len, dim),
        # where seq_len is the length of input sequence
        # valid_length shape is either (batch_size, )
        # or (batch_size, seq_len).

        # Project and transpose query, key, and value from
        # (batch_size, seq_len, hidden_size * num_heads) to
        # (batch_size * num_heads, seq_len, hidden_size).
        
        query = transpose_qkv(self.W_q(query), self.num_heads)
        key = transpose_qkv(self.W_k(key), self.num_heads)
        value = transpose_qkv(self.W_v(value), self.num_heads)
        
        if valid_length is not None:
            # Copy valid_length by num_heads times
            device = valid_length.device
            valid_length = valid_length.cpu().numpy() if valid_length.is_cuda else valid_length.numpy()
            if valid_length.ndim == 1:
                valid_length = torch.FloatTensor(np.tile(valid_length, self.num_heads))
            else:
                valid_length = torch.FloatTensor(np.tile(valid_length, (self.num_heads,1)))

            valid_length = valid_length.to(device)
            
        output = self.attention(query, key, value, valid_length)
        output_concat = transpose_output(output, self.num_heads)
        return self.W_o(output_concat)

def transpose_qkv(X, num_heads):
    # Original X shape: (batch_size, seq_len, hidden_size * num_heads),
    # -1 means inferring its value, after first reshape, X shape:
    # (batch_size, seq_len, num_heads, hidden_size)
    X = X.view(X.shape[0], X.shape[1], num_heads, -1)
    
    # After transpose, X shape: (batch_size, num_heads, seq_len, hidden_size)
    X = X.transpose(2, 1).contiguous()

    # Merge the first two dimensions. Use reverse=True to infer shape from
    # right to left.
    # output shape: (batch_size * num_heads, seq_len, hidden_size)
    output = X.view(-1, X.shape[2], X.shape[3])
    return output


# Saved in the d2l package for later use
def transpose_output(X, num_heads):
    # A reversed version of transpose_qkv
    X = X.view(-1, num_heads, X.shape[1], X.shape[2])
    X = X.transpose(2, 1).contiguous()
    return X.view(X.shape[0], X.shape[1], -1)

4.2 基於位置的前饋網絡

Transformer 模塊另一個非常重要的部分就是基於位置的前饋網絡(FFN),它接受一個形狀爲(batch_size,seq_length, feature_size)的三維張量。Position-wise FFN由兩個全連接層組成,他們作用在最後一維上。因爲序列的每個位置的狀態都會被單獨地更新,所以我們稱他爲position-wise,這等效於一個1x1的卷積。

#實現PositionWiseFFN
# Save to the d2l package.
class PositionWiseFFN(nn.Module):
    def __init__(self, input_size, ffn_hidden_size, hidden_size_out, **kwargs):
        super(PositionWiseFFN, self).__init__(**kwargs)
        self.ffn_1 = nn.Linear(input_size, ffn_hidden_size)
        self.ffn_2 = nn.Linear(ffn_hidden_size, hidden_size_out)
        
        
    def forward(self, X):
        return self.ffn_2(F.relu(self.ffn_1(X)))

與多頭注意力層相似,FFN層同樣只會對最後一維的大小進行改變;除此之外,對於兩個完全相同的輸入,FFN層的輸出也將相等。

4.3 Add and Norm

除了上面兩個模塊之外,Transformer還有一個重要的相加歸一化層,它可以平滑地整合輸入和其他層的輸出,因此我們在每個多頭注意力層和FFN層後面都添加一個含殘差連接的Layer Norm層。這裏 Layer Norm 與7.5小節的Batch Norm很相似,唯一的區別在於Batch Norm是對於batch size這個維度進行計算均值和方差的,而Layer Norm則是對最後一維進行計算。層歸一化可以防止層內的數值變化過大,從而有利於加快訓練速度並且提高泛化性能。

layernorm = nn.LayerNorm(normalized_shape=2, elementwise_affine=True)
batchnorm = nn.BatchNorm1d(num_features=2, affine=True)
X = torch.FloatTensor([[1,2], [3,4]])
print('layer norm:', layernorm(X))
print('batch norm:', batchnorm(X))

# Save to the d2l package.
class AddNorm(nn.Module):
    def __init__(self, hidden_size, dropout, **kwargs):
        super(AddNorm, self).__init__(**kwargs)
        self.dropout = nn.Dropout(dropout)
        self.norm = nn.LayerNorm(hidden_size)
    
    def forward(self, X, Y):
        return self.norm(self.dropout(Y) + X)

4.4 位置編碼

與循環神經網絡不同,無論是多頭注意力網絡還是前饋神經網絡都是獨立地對每個位置的元素進行更新,這種特性幫助我們實現了高效的並行,卻丟失了重要的序列順序的信息。爲了更好的捕捉序列信息,Transformer模型引入了位置編碼去保持輸入序列元素的位置。

class PositionalEncoding(nn.Module):
    def __init__(self, embedding_size, dropout, max_len=1000):
        super(PositionalEncoding, self).__init__()
        self.dropout = nn.Dropout(dropout)
        self.P = np.zeros((1, max_len, embedding_size))
        X = np.arange(0, max_len).reshape(-1, 1) / np.power(
            10000, np.arange(0, embedding_size, 2)/embedding_size)
        self.P[:, :, 0::2] = np.sin(X)
        self.P[:, :, 1::2] = np.cos(X)
        self.P = torch.FloatTensor(self.P)
    
    def forward(self, X):
        if X.is_cuda and not self.P.is_cuda:
            self.P = self.P.cuda()
        X = X + self.P[:, :X.shape[1], :]
        return self.dropout(X)

4.5 編碼器

我們已經有了組成Transformer的各個模塊,現在我們可以開始搭建了!編碼器包含一個多頭注意力層,一個position-wise FFN,和兩個 Add and Norm層。對於attention模型以及FFN模型,我們的輸出維度都是與embedding維度一致的,這也是由於殘差連接天生的特性導致的,因爲我們要將前一層的輸出與原始輸入相加並歸一化。

class EncoderBlock(nn.Module):
    def __init__(self, embedding_size, ffn_hidden_size, num_heads,
                 dropout, **kwargs):
        super(EncoderBlock, self).__init__(**kwargs)
        self.attention = MultiHeadAttention(embedding_size, embedding_size, num_heads, dropout)
        self.addnorm_1 = AddNorm(embedding_size, dropout)
        self.ffn = PositionWiseFFN(embedding_size, ffn_hidden_size, embedding_size)
        self.addnorm_2 = AddNorm(embedding_size, dropout)

    def forward(self, X, valid_length):
        Y = self.addnorm_1(X, self.attention(X, X, X, valid_length))
        return self.addnorm_2(Y, self.ffn(Y))

現在我們來實現整個Transformer 編碼器模型,整個編碼器由n個剛剛定義的Encoder Block堆疊而成,因爲殘差連接的緣故,中間狀態的維度始終與嵌入向量的維度d一致;同時注意到我們把嵌入向量乘以 d−−√ 以防止其值過小

class TransformerEncoder(d2l.Encoder):
    def __init__(self, vocab_size, embedding_size, ffn_hidden_size,
                 num_heads, num_layers, dropout, **kwargs):
        super(TransformerEncoder, self).__init__(**kwargs)
        self.embedding_size = embedding_size
        self.embed = nn.Embedding(vocab_size, embedding_size)
        self.pos_encoding = PositionalEncoding(embedding_size, dropout)
        self.blks = nn.ModuleList()
        for i in range(num_layers):
            self.blks.append(
                EncoderBlock(embedding_size, ffn_hidden_size,
                             num_heads, dropout))

    def forward(self, X, valid_length, *args):
        X = self.pos_encoding(self.embed(X) * math.sqrt(self.embedding_size))
        for blk in self.blks:
            X = blk(X, valid_length)
        return X

4.6 解碼器

Transformer 模型的解碼器與編碼器結構類似,然而,除了之前介紹的幾個模塊之外,編碼器部分有另一個子模塊。該模塊也是多頭注意力層,接受編碼器的輸出作爲key和value,decoder的狀態作爲query。與編碼器部分相類似,解碼器同樣是使用了add and norm機制,用殘差和層歸一化將各個子層的輸出相連。

class DecoderBlock(nn.Module):
    def __init__(self, embedding_size, ffn_hidden_size, num_heads,dropout,i,**kwargs):
        super(DecoderBlock, self).__init__(**kwargs)
        self.i = i
        self.attention_1 = MultiHeadAttention(embedding_size, embedding_size, num_heads, dropout)
        self.addnorm_1 = AddNorm(embedding_size, dropout)
        self.attention_2 = MultiHeadAttention(embedding_size, embedding_size, num_heads, dropout)
        self.addnorm_2 = AddNorm(embedding_size, dropout)
        self.ffn = PositionWiseFFN(embedding_size, ffn_hidden_size, embedding_size)
        self.addnorm_3 = AddNorm(embedding_size, dropout)
    
    def forward(self, X, state):
        enc_outputs, enc_valid_length = state[0], state[1]
        
        # state[2][self.i] stores all the previous t-1 query state of layer-i
        # len(state[2]) = num_layers
        
        # If training:
        #     state[2] is useless.
        # If predicting:
        #     In the t-th timestep:
        #         state[2][self.i].shape = (batch_size, t-1, hidden_size)
        # Demo:
        # love dogs ! [EOS]
        #  |    |   |   |
        #   Transformer 
        #    Decoder
        #  |   |   |   |
        #  I love dogs !
        
        if state[2][self.i] is None:
            key_values = X
        else:
            # shape of key_values = (batch_size, t, hidden_size)
            key_values = torch.cat((state[2][self.i], X), dim=1) 
        state[2][self.i] = key_values
        
        if self.training:
            batch_size, seq_len, _ = X.shape
            # Shape: (batch_size, seq_len), the values in the j-th column are j+1
            valid_length = torch.FloatTensor(np.tile(np.arange(1, seq_len+1), (batch_size, 1))) 
            valid_length = valid_length.to(X.device)
        else:
            valid_length = None

        X2 = self.attention_1(X, key_values, key_values, valid_length)
        Y = self.addnorm_1(X, X2)
        Y2 = self.attention_2(Y, enc_outputs, enc_outputs, enc_valid_length)
        Z = self.addnorm_2(Y, Y2)
        return self.addnorm_3(Z, self.ffn(Z)), state

對於Transformer解碼器來說,構造方式與編碼器一樣,除了最後一層添加一個dense layer以獲得輸出的置信度分數。下面讓我們來實現一下Transformer Decoder,除了常規的超參數例如vocab_size embedding_size 之外,解碼器還需要編碼器的輸出 enc_outputs 和句子有效長度 enc_valid_length。

class TransformerDecoder(d2l.Decoder):
    def __init__(self, vocab_size, embedding_size, ffn_hidden_size,
                 num_heads, num_layers, dropout, **kwargs):
        super(TransformerDecoder, self).__init__(**kwargs)
        self.embedding_size = embedding_size
        self.num_layers = num_layers
        self.embed = nn.Embedding(vocab_size, embedding_size)
        self.pos_encoding = PositionalEncoding(embedding_size, dropout)
        self.blks = nn.ModuleList()
        for i in range(num_layers):
            self.blks.append(
                DecoderBlock(embedding_size, ffn_hidden_size, num_heads,
                             dropout, i))
        self.dense = nn.Linear(embedding_size, vocab_size)

    def init_state(self, enc_outputs, enc_valid_length, *args):
        return [enc_outputs, enc_valid_length, [None]*self.num_layers]

    def forward(self, X, state):
        X = self.pos_encoding(self.embed(X) * math.sqrt(self.embedding_size))
        for blk in self.blks:
            X, state = blk(X, state)
        return self.dense(X), state

4.7 訓練

import zipfile
import torch
import requests
from io import BytesIO
from torch.utils import data
import sys
import collections

class Vocab(object): # This class is saved in d2l.
  def __init__(self, tokens, min_freq=0, use_special_tokens=False):
    # sort by frequency and token
    counter = collections.Counter(tokens)
    token_freqs = sorted(counter.items(), key=lambda x: x[0])
    token_freqs.sort(key=lambda x: x[1], reverse=True)
    if use_special_tokens:
      # padding, begin of sentence, end of sentence, unknown
      self.pad, self.bos, self.eos, self.unk = (0, 1, 2, 3)
      tokens = ['', '', '', '']
    else:
      self.unk = 0
      tokens = ['']
    tokens += [token for token, freq in token_freqs if freq >= min_freq]
    self.idx_to_token = []
    self.token_to_idx = dict()
    for token in tokens:
      self.idx_to_token.append(token)
      self.token_to_idx[token] = len(self.idx_to_token) - 1
      
  def __len__(self):
    return len(self.idx_to_token)
  
  def __getitem__(self, tokens):
    if not isinstance(tokens, (list, tuple)):
      return self.token_to_idx.get(tokens, self.unk)
    else:
      return [self.__getitem__(token) for token in tokens]
    
  def to_tokens(self, indices):
    if not isinstance(indices, (list, tuple)):
      return self.idx_to_token[indices]
    else:
      return [self.idx_to_token[index] for index in indices]

def load_data_nmt(batch_size, max_len, num_examples=1000):
    """Download an NMT dataset, return its vocabulary and data iterator."""
    # Download and preprocess
    def preprocess_raw(text):
        text = text.replace('\u202f', ' ').replace('\xa0', ' ')
        out = ''
        for i, char in enumerate(text.lower()):
            if char in (',', '!', '.') and text[i-1] != ' ':
                out += ' '
            out += char
        return out 


    with open('/home/kesci/input/fraeng6506/fra.txt', 'r') as f:
      raw_text = f.read()


    text = preprocess_raw(raw_text)

    # Tokenize
    source, target = [], []
    for i, line in enumerate(text.split('\n')):
        if i >= num_examples:
            break
        parts = line.split('\t')
        if len(parts) >= 2:
            source.append(parts[0].split(' '))
            target.append(parts[1].split(' '))

    # Build vocab
    def build_vocab(tokens):
        tokens = [token for line in tokens for token in line]
        return Vocab(tokens, min_freq=3, use_special_tokens=True)
    src_vocab, tgt_vocab = build_vocab(source), build_vocab(target)

    # Convert to index arrays
    def pad(line, max_len, padding_token):
        if len(line) > max_len:
            return line[:max_len]
        return line + [padding_token] * (max_len - len(line))

    def build_array(lines, vocab, max_len, is_source):
        lines = [vocab[line] for line in lines]
        if not is_source:
            lines = [[vocab.bos] + line + [vocab.eos] for line in lines]
        array = torch.tensor([pad(line, max_len, vocab.pad) for line in lines])
        valid_len = (array != vocab.pad).sum(1)
        return array, valid_len

    src_vocab, tgt_vocab = build_vocab(source), build_vocab(target)
    src_array, src_valid_len = build_array(source, src_vocab, max_len, True)
    tgt_array, tgt_valid_len = build_array(target, tgt_vocab, max_len, False)
    train_data = data.TensorDataset(src_array, src_valid_len, tgt_array, tgt_valid_len)
    train_iter = data.DataLoader(train_data, batch_size, shuffle=True)
    return src_vocab, tgt_vocab, train_iter

import os

import d2l

# 平臺暫時不支持gpu,現在會自動使用cpu訓練,gpu可以用了之後會使用gpu來訓練
os.environ["CUDA_VISIBLE_DEVICES"] = "1"

embed_size, embedding_size, num_layers, dropout = 32, 32, 2, 0.05
batch_size, num_steps = 64, 10
lr, num_epochs, ctx = 0.005, 250, d2l.try_gpu()
print(ctx)
num_hiddens, num_heads = 64, 4

src_vocab, tgt_vocab, train_iter = load_data_nmt(batch_size, num_steps)

encoder = TransformerEncoder(
    len(src_vocab), embedding_size, num_hiddens, num_heads, num_layers,
    dropout)
decoder = TransformerDecoder(
    len(src_vocab), embedding_size, num_hiddens, num_heads, num_layers,
    dropout)
model = d2l.EncoderDecoder(encoder, decoder)
d2l.train_s2s_ch9(model, train_iter, lr, num_epochs, ctx)

model.eval()
for sentence in ['Go .', 'Wow !', "I'm OK .", 'I won !']:
    print(sentence + ' => ' + d2l.predict_s2s_ch9(
        model, sentence, src_vocab, tgt_vocab, num_steps, ctx))
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