Upload folder using huggingface_hub
Browse files- config.json +34 -0
- configuration_helmbert.py +104 -0
- model.safetensors +3 -0
- modeling_helmbert.py +988 -0
- special_tokens_map.json +9 -0
- tokenization_helmbert.py +285 -0
- tokenizer_config.json +58 -0
- vocab.json +80 -0
config.json
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{
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"architectures": [
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"HELMBertForMaskedLM"
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],
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"attention_probs_dropout_prob": 0.1,
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"bos_token_id": 1,
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"dtype": "float32",
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"eos_token_id": 2,
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"hidden_dropout_prob": 0.1,
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"hidden_size": 256,
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"intermediate_size": 3072,
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"mask_token_id": 4,
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"max_position_embeddings": 512,
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"max_relative_positions": 512,
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"model_type": "helmbert",
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"ngie_dropout": 0.1,
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"ngie_kernel_size": 3,
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"num_attention_heads": 4,
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"num_hidden_layers": 2,
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"pad_token_id": 0,
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"pos_att_type": "c2p|p2c",
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"position_buckets": 256,
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"sep_token_id": 2,
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"share_att_key": false,
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"transformers_version": "4.57.3",
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"vocab_size": 78,
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"auto_map": {
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"AutoConfig": "configuration_helmbert.HELMBertConfig",
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"AutoModel": "modeling_helmbert.HELMBertModel",
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"AutoModelForMaskedLM": "modeling_helmbert.HELMBertForMaskedLM",
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"AutoModelForSequenceClassification": "modeling_helmbert.HELMBertForSequenceClassification",
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"AutoTokenizer": "tokenization_helmbert.HELMBertTokenizer"
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}
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}
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configuration_helmbert.py
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"""HELM-BERT configuration."""
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from transformers import PretrainedConfig
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class HELMBertConfig(PretrainedConfig):
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"""Configuration class for HELM-BERT model.
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This configuration class stores all the parameters needed to instantiate a HELM-BERT model.
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It inherits from PretrainedConfig and can be used with HuggingFace's from_pretrained and
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save_pretrained methods.
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Args:
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vocab_size: Size of the vocabulary (default: 78 for HELM character vocabulary)
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hidden_size: Dimensionality of the encoder layers (default: 768)
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num_hidden_layers: Number of transformer layers (default: 6)
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num_attention_heads: Number of attention heads (default: 12)
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intermediate_size: Dimensionality of the feed-forward layer (default: 3072)
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hidden_dropout_prob: Dropout probability for hidden layers (default: 0.1)
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attention_probs_dropout_prob: Dropout probability for attention (default: 0.1)
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max_position_embeddings: Maximum sequence length (default: 512)
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max_relative_positions: Maximum relative position distance (default: 512)
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position_buckets: Number of position buckets for log-bucketing (default: 256)
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pos_att_type: Position attention types, pipe-separated (default: "c2p|p2c")
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share_att_key: Whether to share attention key projections (default: False)
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ngie_kernel_size: Kernel size for nGiE convolution (default: 3)
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ngie_dropout: Dropout for nGiE layer (default: 0.1)
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pad_token_id: ID of padding token (default: 0)
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bos_token_id: ID of beginning-of-sequence token (default: 1)
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eos_token_id: ID of end-of-sequence token (default: 2)
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sep_token_id: ID of separator token (default: 2)
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mask_token_id: ID of mask token (default: 4)
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Example:
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>>> from helmbert import HELMBertConfig, HELMBertModel
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>>> config = HELMBertConfig(hidden_size=768, num_hidden_layers=6)
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>>> model = HELMBertModel(config)
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"""
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model_type = "helmbert"
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def __init__(
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self,
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vocab_size: int = 78,
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hidden_size: int = 768,
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num_hidden_layers: int = 6,
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num_attention_heads: int = 12,
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intermediate_size: int = 3072,
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hidden_dropout_prob: float = 0.1,
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attention_probs_dropout_prob: float = 0.1,
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max_position_embeddings: int = 512,
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# Disentangled attention parameters
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max_relative_positions: int = 512,
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position_buckets: int = 256,
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pos_att_type: str = "c2p|p2c",
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share_att_key: bool = False,
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# nGiE parameters
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ngie_kernel_size: int = 3,
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ngie_dropout: float = 0.1,
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# Special token IDs
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pad_token_id: int = 0,
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bos_token_id: int = 1,
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eos_token_id: int = 2,
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sep_token_id: int = 2,
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mask_token_id: int = 4,
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# Classification/regression
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num_labels: int = 2,
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problem_type: str = None,
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**kwargs,
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):
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super().__init__(
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pad_token_id=pad_token_id,
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bos_token_id=bos_token_id,
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eos_token_id=eos_token_id,
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**kwargs,
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)
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# Core transformer parameters
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self.vocab_size = vocab_size
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self.hidden_size = hidden_size
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self.num_hidden_layers = num_hidden_layers
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self.num_attention_heads = num_attention_heads
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self.intermediate_size = intermediate_size
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self.hidden_dropout_prob = hidden_dropout_prob
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self.attention_probs_dropout_prob = attention_probs_dropout_prob
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self.max_position_embeddings = max_position_embeddings
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# Disentangled attention parameters
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self.max_relative_positions = max_relative_positions
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self.position_buckets = position_buckets
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self.pos_att_type = pos_att_type
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self.share_att_key = share_att_key
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# nGiE parameters
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self.ngie_kernel_size = ngie_kernel_size
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self.ngie_dropout = ngie_dropout
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# Special token IDs
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self.sep_token_id = sep_token_id
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self.mask_token_id = mask_token_id
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# Classification/regression
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self.num_labels = num_labels
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self.problem_type = problem_type
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model.safetensors
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version https://git-lfs.github.com/spec/v1
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oid sha256:4b2a6686b46de073e9a373938637fe0de1817cfb1fd2961f7daf1e4dafb7ced9
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size 18489472
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modeling_helmbert.py
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|
|
| 1 |
+
"""HELM-BERT model implementation.
|
| 2 |
+
|
| 3 |
+
This module implements the HELM-BERT model with:
|
| 4 |
+
- Disentangled attention (DeBERTa-style)
|
| 5 |
+
- Enhanced Mask Decoder (EMD) for MLM
|
| 6 |
+
- n-gram Induced Encoding (nGiE) layer
|
| 7 |
+
"""
|
| 8 |
+
|
| 9 |
+
import math
|
| 10 |
+
from dataclasses import dataclass
|
| 11 |
+
from typing import Any, Dict, Optional, Tuple, Union
|
| 12 |
+
|
| 13 |
+
import torch
|
| 14 |
+
import torch.nn as nn
|
| 15 |
+
import torch.nn.functional as F
|
| 16 |
+
from packaging import version
|
| 17 |
+
from torch import _softmax_backward_data
|
| 18 |
+
from transformers import PreTrainedModel
|
| 19 |
+
from transformers.modeling_outputs import (
|
| 20 |
+
BaseModelOutput,
|
| 21 |
+
BaseModelOutputWithPooling,
|
| 22 |
+
MaskedLMOutput,
|
| 23 |
+
SequenceClassifierOutput,
|
| 24 |
+
)
|
| 25 |
+
|
| 26 |
+
from .configuration_helmbert import HELMBertConfig
|
| 27 |
+
|
| 28 |
+
|
| 29 |
+
# -----------------------------------------------------------------------------
|
| 30 |
+
# Utility Functions
|
| 31 |
+
# -----------------------------------------------------------------------------
|
| 32 |
+
|
| 33 |
+
|
| 34 |
+
def masked_layer_norm(
|
| 35 |
+
layer_norm: nn.LayerNorm, x: torch.Tensor, mask: Optional[torch.Tensor] = None
|
| 36 |
+
) -> torch.Tensor:
|
| 37 |
+
"""Apply LayerNorm with masking to avoid updates on padding tokens.
|
| 38 |
+
|
| 39 |
+
Args:
|
| 40 |
+
layer_norm: LayerNorm module
|
| 41 |
+
x: Input tensor (batch_size, seq_len, hidden_size)
|
| 42 |
+
mask: Mask tensor where 0 = padding (ignored), 1 = valid token
|
| 43 |
+
|
| 44 |
+
Returns:
|
| 45 |
+
Normalized tensor with padding positions zeroed out
|
| 46 |
+
"""
|
| 47 |
+
output = layer_norm(x).to(x)
|
| 48 |
+
if mask is None:
|
| 49 |
+
return output
|
| 50 |
+
if mask.dim() != x.dim():
|
| 51 |
+
if mask.dim() == 4:
|
| 52 |
+
mask = mask.squeeze(1).squeeze(1)
|
| 53 |
+
mask = mask.unsqueeze(2)
|
| 54 |
+
mask = mask.to(output.dtype)
|
| 55 |
+
return output * mask
|
| 56 |
+
|
| 57 |
+
|
| 58 |
+
class XSoftmax(torch.autograd.Function):
|
| 59 |
+
"""Masked Softmax optimized for memory efficiency."""
|
| 60 |
+
|
| 61 |
+
@staticmethod
|
| 62 |
+
def forward(ctx, input: torch.Tensor, mask: Optional[torch.Tensor], dim: int) -> torch.Tensor:
|
| 63 |
+
ctx.dim = dim
|
| 64 |
+
if mask is not None:
|
| 65 |
+
rmask = ~(mask.bool())
|
| 66 |
+
if rmask.dim() == 2:
|
| 67 |
+
rmask = rmask.unsqueeze(1).unsqueeze(2)
|
| 68 |
+
elif rmask.dim() == 3:
|
| 69 |
+
rmask = rmask.unsqueeze(2)
|
| 70 |
+
output = input.masked_fill(rmask, float("-inf"))
|
| 71 |
+
else:
|
| 72 |
+
output = input
|
| 73 |
+
output = torch.softmax(output, ctx.dim)
|
| 74 |
+
if mask is not None:
|
| 75 |
+
output.masked_fill_(rmask, 0)
|
| 76 |
+
ctx.save_for_backward(output)
|
| 77 |
+
return output
|
| 78 |
+
|
| 79 |
+
@staticmethod
|
| 80 |
+
def backward(ctx, grad_output: torch.Tensor) -> Tuple[torch.Tensor, None, None]:
|
| 81 |
+
(output,) = ctx.saved_tensors
|
| 82 |
+
if version.Version(torch.__version__) >= version.Version("1.11.0"):
|
| 83 |
+
input_grad = _softmax_backward_data(grad_output, output, ctx.dim, output.dtype)
|
| 84 |
+
else:
|
| 85 |
+
input_grad = _softmax_backward_data(grad_output, output, ctx.dim, output)
|
| 86 |
+
return input_grad, None, None
|
| 87 |
+
|
| 88 |
+
|
| 89 |
+
def build_relative_position(
|
| 90 |
+
query_size: int,
|
| 91 |
+
key_size: int,
|
| 92 |
+
bucket_size: int = -1,
|
| 93 |
+
max_position: int = 512,
|
| 94 |
+
device: Optional[torch.device] = None,
|
| 95 |
+
) -> torch.Tensor:
|
| 96 |
+
"""Build relative position matrix with optional log-bucketing."""
|
| 97 |
+
q_ids = torch.arange(query_size, dtype=torch.long, device=device)
|
| 98 |
+
k_ids = torch.arange(key_size, dtype=torch.long, device=device)
|
| 99 |
+
rel_pos = q_ids.unsqueeze(1) - k_ids.unsqueeze(0)
|
| 100 |
+
|
| 101 |
+
if bucket_size > 0:
|
| 102 |
+
rel_buckets = 0
|
| 103 |
+
num_buckets = bucket_size
|
| 104 |
+
rel_buckets += (rel_pos > 0).long() * (num_buckets // 2)
|
| 105 |
+
rel_pos = torch.abs(rel_pos)
|
| 106 |
+
|
| 107 |
+
max_exact = num_buckets // 4
|
| 108 |
+
is_small = rel_pos < max_exact
|
| 109 |
+
|
| 110 |
+
rel_pos_if_large = max_exact + (
|
| 111 |
+
torch.log(rel_pos.float() / max_exact)
|
| 112 |
+
/ math.log(max_position / max_exact)
|
| 113 |
+
* (num_buckets // 4 - 1)
|
| 114 |
+
).long()
|
| 115 |
+
rel_pos_if_large = torch.min(
|
| 116 |
+
rel_pos_if_large, torch.full_like(rel_pos_if_large, num_buckets // 2 - 1)
|
| 117 |
+
)
|
| 118 |
+
|
| 119 |
+
rel_buckets += torch.where(is_small, rel_pos, rel_pos_if_large)
|
| 120 |
+
return rel_buckets
|
| 121 |
+
else:
|
| 122 |
+
rel_pos = torch.clamp(rel_pos, -max_position, max_position)
|
| 123 |
+
return rel_pos + max_position
|
| 124 |
+
|
| 125 |
+
|
| 126 |
+
# -----------------------------------------------------------------------------
|
| 127 |
+
# Attention Modules
|
| 128 |
+
# -----------------------------------------------------------------------------
|
| 129 |
+
|
| 130 |
+
|
| 131 |
+
class DisentangledSelfAttention(nn.Module):
|
| 132 |
+
"""Disentangled self-attention with content and position separation.
|
| 133 |
+
|
| 134 |
+
Implements content-to-content, content-to-position, and position-to-content
|
| 135 |
+
attention as described in DeBERTa.
|
| 136 |
+
"""
|
| 137 |
+
|
| 138 |
+
def __init__(self, config: HELMBertConfig):
|
| 139 |
+
super().__init__()
|
| 140 |
+
|
| 141 |
+
if config.hidden_size % config.num_attention_heads != 0:
|
| 142 |
+
raise ValueError(
|
| 143 |
+
f"hidden_size ({config.hidden_size}) must be divisible by "
|
| 144 |
+
f"num_attention_heads ({config.num_attention_heads})"
|
| 145 |
+
)
|
| 146 |
+
|
| 147 |
+
self.num_heads = config.num_attention_heads
|
| 148 |
+
self.head_size = config.hidden_size // config.num_attention_heads
|
| 149 |
+
self.all_head_size = self.num_heads * self.head_size
|
| 150 |
+
|
| 151 |
+
# Content projections
|
| 152 |
+
self.query_proj = nn.Linear(config.hidden_size, self.all_head_size, bias=True)
|
| 153 |
+
self.key_proj = nn.Linear(config.hidden_size, self.all_head_size, bias=True)
|
| 154 |
+
self.value_proj = nn.Linear(config.hidden_size, self.all_head_size, bias=True)
|
| 155 |
+
|
| 156 |
+
# Position attention configuration
|
| 157 |
+
self.pos_att_type = [x.strip() for x in config.pos_att_type.lower().split("|")]
|
| 158 |
+
self.max_relative_positions = config.max_relative_positions
|
| 159 |
+
self.position_buckets = config.position_buckets
|
| 160 |
+
self.share_att_key = config.share_att_key
|
| 161 |
+
|
| 162 |
+
# Position embedding size
|
| 163 |
+
self.pos_ebd_size = config.max_relative_positions
|
| 164 |
+
if config.position_buckets > 0:
|
| 165 |
+
self.pos_ebd_size = config.position_buckets
|
| 166 |
+
|
| 167 |
+
# Position embeddings
|
| 168 |
+
self.rel_embeddings = nn.Embedding(self.pos_ebd_size * 2, config.hidden_size)
|
| 169 |
+
|
| 170 |
+
# Position projections
|
| 171 |
+
if not self.share_att_key:
|
| 172 |
+
if "c2p" in self.pos_att_type or "p2p" in self.pos_att_type:
|
| 173 |
+
self.pos_key_proj = nn.Linear(config.hidden_size, self.all_head_size, bias=True)
|
| 174 |
+
if "p2c" in self.pos_att_type or "p2p" in self.pos_att_type:
|
| 175 |
+
self.pos_query_proj = nn.Linear(config.hidden_size, self.all_head_size, bias=False)
|
| 176 |
+
|
| 177 |
+
# Dropout
|
| 178 |
+
self.dropout = nn.Dropout(config.attention_probs_dropout_prob)
|
| 179 |
+
self.pos_dropout = nn.Dropout(config.attention_probs_dropout_prob)
|
| 180 |
+
|
| 181 |
+
def transpose_for_scores(self, x: torch.Tensor) -> torch.Tensor:
|
| 182 |
+
"""Reshape tensor for attention computation."""
|
| 183 |
+
new_shape = x.size()[:-1] + (self.num_heads, self.head_size)
|
| 184 |
+
x = x.view(*new_shape)
|
| 185 |
+
return x.permute(0, 2, 1, 3).contiguous().view(-1, x.size(1), x.size(-1))
|
| 186 |
+
|
| 187 |
+
def forward(
|
| 188 |
+
self,
|
| 189 |
+
hidden_states: torch.Tensor,
|
| 190 |
+
attention_mask: Optional[torch.Tensor] = None,
|
| 191 |
+
output_attentions: bool = False,
|
| 192 |
+
query_states: Optional[torch.Tensor] = None,
|
| 193 |
+
relative_pos: Optional[torch.Tensor] = None,
|
| 194 |
+
rel_embeddings: Optional[torch.Tensor] = None,
|
| 195 |
+
) -> Dict[str, Any]:
|
| 196 |
+
"""Forward pass of disentangled attention."""
|
| 197 |
+
if query_states is None:
|
| 198 |
+
query_states = hidden_states
|
| 199 |
+
|
| 200 |
+
# Compute Q, K, V
|
| 201 |
+
query_layer = self.transpose_for_scores(self.query_proj(query_states)).float()
|
| 202 |
+
key_layer = self.transpose_for_scores(self.key_proj(hidden_states)).float()
|
| 203 |
+
value_layer = self.transpose_for_scores(self.value_proj(hidden_states))
|
| 204 |
+
|
| 205 |
+
# Calculate scale factor
|
| 206 |
+
scale_factor = 1
|
| 207 |
+
if "c2p" in self.pos_att_type:
|
| 208 |
+
scale_factor += 1
|
| 209 |
+
if "p2c" in self.pos_att_type:
|
| 210 |
+
scale_factor += 1
|
| 211 |
+
if "p2p" in self.pos_att_type:
|
| 212 |
+
scale_factor += 1
|
| 213 |
+
|
| 214 |
+
scale = 1.0 / math.sqrt(self.head_size * scale_factor)
|
| 215 |
+
|
| 216 |
+
# Content-to-content attention (c2c)
|
| 217 |
+
c2c_scores = torch.bmm(query_layer, key_layer.transpose(-1, -2) * scale)
|
| 218 |
+
attention_scores = c2c_scores
|
| 219 |
+
|
| 220 |
+
# Add relative position bias if enabled
|
| 221 |
+
if len(self.pos_att_type) > 0 and self.pos_att_type[0]:
|
| 222 |
+
rel_att = self._disentangled_attention_bias(
|
| 223 |
+
query_layer, key_layer, relative_pos, rel_embeddings, scale_factor
|
| 224 |
+
)
|
| 225 |
+
if rel_att is not None:
|
| 226 |
+
attention_scores = attention_scores + rel_att
|
| 227 |
+
|
| 228 |
+
# Normalize scores for numerical stability
|
| 229 |
+
attention_scores = attention_scores - attention_scores.max(dim=-1, keepdim=True)[0].detach()
|
| 230 |
+
attention_scores = attention_scores.to(hidden_states.dtype)
|
| 231 |
+
|
| 232 |
+
# Reshape for XSoftmax
|
| 233 |
+
attention_scores = attention_scores.view(
|
| 234 |
+
-1, self.num_heads, attention_scores.size(-2), attention_scores.size(-1)
|
| 235 |
+
)
|
| 236 |
+
|
| 237 |
+
# Apply XSoftmax
|
| 238 |
+
attention_probs = XSoftmax.apply(attention_scores, attention_mask, -1)
|
| 239 |
+
attention_probs = self.dropout(attention_probs)
|
| 240 |
+
|
| 241 |
+
# Apply attention to values
|
| 242 |
+
attention_probs_flat = attention_probs.view(-1, attention_probs.size(-2), attention_probs.size(-1))
|
| 243 |
+
context_layer = torch.bmm(attention_probs_flat, value_layer)
|
| 244 |
+
|
| 245 |
+
# Reshape output
|
| 246 |
+
context_layer = context_layer.view(-1, self.num_heads, context_layer.size(-2), context_layer.size(-1))
|
| 247 |
+
context_layer = context_layer.permute(0, 2, 1, 3).contiguous()
|
| 248 |
+
new_shape = context_layer.size()[:-2] + (self.all_head_size,)
|
| 249 |
+
context_layer = context_layer.view(*new_shape)
|
| 250 |
+
|
| 251 |
+
result = {"hidden_states": context_layer, "attention_probs": attention_probs}
|
| 252 |
+
return result
|
| 253 |
+
|
| 254 |
+
def _disentangled_attention_bias(
|
| 255 |
+
self,
|
| 256 |
+
query_layer: torch.Tensor,
|
| 257 |
+
key_layer: torch.Tensor,
|
| 258 |
+
relative_pos: Optional[torch.Tensor],
|
| 259 |
+
rel_embeddings: Optional[torch.Tensor],
|
| 260 |
+
scale_factor: int,
|
| 261 |
+
) -> Optional[torch.Tensor]:
|
| 262 |
+
"""Compute disentangled attention bias."""
|
| 263 |
+
if relative_pos is None:
|
| 264 |
+
q_size = query_layer.size(-2)
|
| 265 |
+
k_size = key_layer.size(-2)
|
| 266 |
+
relative_pos = build_relative_position(
|
| 267 |
+
q_size,
|
| 268 |
+
k_size,
|
| 269 |
+
bucket_size=self.position_buckets,
|
| 270 |
+
max_position=self.max_relative_positions,
|
| 271 |
+
device=query_layer.device,
|
| 272 |
+
)
|
| 273 |
+
|
| 274 |
+
if relative_pos.dim() == 2:
|
| 275 |
+
relative_pos = relative_pos.unsqueeze(0).unsqueeze(0)
|
| 276 |
+
elif relative_pos.dim() == 3:
|
| 277 |
+
relative_pos = relative_pos.unsqueeze(1)
|
| 278 |
+
|
| 279 |
+
batch_size = query_layer.size(0) // self.num_heads
|
| 280 |
+
|
| 281 |
+
# Get position embeddings
|
| 282 |
+
if rel_embeddings is None:
|
| 283 |
+
rel_embeddings = self.rel_embeddings.weight
|
| 284 |
+
|
| 285 |
+
att_span = self.pos_ebd_size
|
| 286 |
+
rel_embeddings = rel_embeddings[
|
| 287 |
+
self.pos_ebd_size - att_span : self.pos_ebd_size + att_span, :
|
| 288 |
+
].unsqueeze(0)
|
| 289 |
+
rel_embeddings = self.pos_dropout(rel_embeddings)
|
| 290 |
+
|
| 291 |
+
score = torch.zeros_like(query_layer[:, :, :1]).expand(-1, -1, key_layer.size(-2))
|
| 292 |
+
|
| 293 |
+
# Prepare position indices
|
| 294 |
+
c2p_pos = torch.clamp(relative_pos + att_span, 0, att_span * 2 - 1)
|
| 295 |
+
c2p_pos = c2p_pos.squeeze(0).expand(query_layer.size(0), query_layer.size(1), relative_pos.size(-1))
|
| 296 |
+
|
| 297 |
+
# Content-to-position (c2p)
|
| 298 |
+
if "c2p" in self.pos_att_type:
|
| 299 |
+
pos_key_layer = (
|
| 300 |
+
self.pos_key_proj(rel_embeddings) if not self.share_att_key else self.key_proj(rel_embeddings)
|
| 301 |
+
)
|
| 302 |
+
pos_key_layer = self.transpose_for_scores(pos_key_layer).repeat(batch_size, 1, 1)
|
| 303 |
+
|
| 304 |
+
c2p_scale = 1.0 / math.sqrt(self.head_size * scale_factor)
|
| 305 |
+
c2p_att = torch.bmm(query_layer, pos_key_layer.transpose(-1, -2) * c2p_scale)
|
| 306 |
+
c2p_att = torch.gather(c2p_att, dim=-1, index=c2p_pos)
|
| 307 |
+
score = score + c2p_att
|
| 308 |
+
|
| 309 |
+
# Position-to-content (p2c)
|
| 310 |
+
if "p2c" in self.pos_att_type:
|
| 311 |
+
pos_query_layer = (
|
| 312 |
+
self.pos_query_proj(rel_embeddings) if not self.share_att_key else self.query_proj(rel_embeddings)
|
| 313 |
+
)
|
| 314 |
+
pos_query_layer = self.transpose_for_scores(pos_query_layer).repeat(batch_size, 1, 1)
|
| 315 |
+
|
| 316 |
+
p2c_scale = 1.0 / math.sqrt(self.head_size * scale_factor)
|
| 317 |
+
p2c_att = torch.bmm(pos_query_layer * p2c_scale, key_layer.transpose(-1, -2))
|
| 318 |
+
p2c_att = torch.gather(p2c_att, dim=-2, index=c2p_pos)
|
| 319 |
+
score = score + p2c_att
|
| 320 |
+
|
| 321 |
+
return score
|
| 322 |
+
|
| 323 |
+
|
| 324 |
+
# -----------------------------------------------------------------------------
|
| 325 |
+
# Transformer Components
|
| 326 |
+
# -----------------------------------------------------------------------------
|
| 327 |
+
|
| 328 |
+
|
| 329 |
+
class HELMBertEmbeddings(nn.Module):
|
| 330 |
+
"""Token and position embeddings for HELM-BERT."""
|
| 331 |
+
|
| 332 |
+
def __init__(self, config: HELMBertConfig):
|
| 333 |
+
super().__init__()
|
| 334 |
+
self.word_embeddings = nn.Embedding(
|
| 335 |
+
config.vocab_size, config.hidden_size, padding_idx=config.pad_token_id
|
| 336 |
+
)
|
| 337 |
+
self.position_embeddings = nn.Embedding(config.max_position_embeddings, config.hidden_size)
|
| 338 |
+
self.layer_norm = nn.LayerNorm(config.hidden_size)
|
| 339 |
+
self.dropout = nn.Dropout(config.hidden_dropout_prob)
|
| 340 |
+
|
| 341 |
+
def forward(
|
| 342 |
+
self,
|
| 343 |
+
input_ids: torch.Tensor,
|
| 344 |
+
attention_mask: Optional[torch.Tensor] = None,
|
| 345 |
+
) -> Tuple[torch.Tensor, torch.Tensor]:
|
| 346 |
+
"""Forward pass.
|
| 347 |
+
|
| 348 |
+
Returns:
|
| 349 |
+
Tuple of (token_embeddings, position_embeddings)
|
| 350 |
+
"""
|
| 351 |
+
batch_size, seq_len = input_ids.shape
|
| 352 |
+
|
| 353 |
+
# Token embeddings
|
| 354 |
+
embeddings = self.word_embeddings(input_ids)
|
| 355 |
+
|
| 356 |
+
# Position embeddings
|
| 357 |
+
position_ids = torch.arange(seq_len, dtype=torch.long, device=input_ids.device)
|
| 358 |
+
position_ids = position_ids.unsqueeze(0).expand(batch_size, -1)
|
| 359 |
+
position_embeds = self.position_embeddings(position_ids)
|
| 360 |
+
|
| 361 |
+
# Layer norm and dropout
|
| 362 |
+
embeddings = masked_layer_norm(self.layer_norm, embeddings, attention_mask)
|
| 363 |
+
embeddings = self.dropout(embeddings)
|
| 364 |
+
|
| 365 |
+
return embeddings, position_embeds
|
| 366 |
+
|
| 367 |
+
|
| 368 |
+
class NgieLayer(nn.Module):
|
| 369 |
+
"""n-gram Induced Input Encoding (nGiE) layer.
|
| 370 |
+
|
| 371 |
+
Captures local n-gram patterns using 1D convolution.
|
| 372 |
+
"""
|
| 373 |
+
|
| 374 |
+
def __init__(self, config: HELMBertConfig):
|
| 375 |
+
super().__init__()
|
| 376 |
+
|
| 377 |
+
self.conv = nn.Conv1d(
|
| 378 |
+
in_channels=config.hidden_size,
|
| 379 |
+
out_channels=config.hidden_size,
|
| 380 |
+
kernel_size=config.ngie_kernel_size,
|
| 381 |
+
padding=(config.ngie_kernel_size - 1) // 2,
|
| 382 |
+
groups=1,
|
| 383 |
+
)
|
| 384 |
+
self.activation = nn.Tanh()
|
| 385 |
+
self.layer_norm = nn.LayerNorm(config.hidden_size)
|
| 386 |
+
self.dropout = nn.Dropout(config.ngie_dropout)
|
| 387 |
+
|
| 388 |
+
def forward(
|
| 389 |
+
self,
|
| 390 |
+
hidden_states: torch.Tensor,
|
| 391 |
+
residual_states: torch.Tensor,
|
| 392 |
+
attention_mask: torch.Tensor,
|
| 393 |
+
) -> torch.Tensor:
|
| 394 |
+
"""Forward pass.
|
| 395 |
+
|
| 396 |
+
Args:
|
| 397 |
+
hidden_states: Input to convolution (batch, seq, hidden)
|
| 398 |
+
residual_states: States for residual connection (batch, seq, hidden)
|
| 399 |
+
attention_mask: Mask where 1 = valid, 0 = padding
|
| 400 |
+
|
| 401 |
+
Returns:
|
| 402 |
+
Output with n-gram information incorporated
|
| 403 |
+
"""
|
| 404 |
+
# Apply 1D convolution
|
| 405 |
+
out = self.conv(hidden_states.permute(0, 2, 1).contiguous()).permute(0, 2, 1).contiguous()
|
| 406 |
+
|
| 407 |
+
# Create reverse mask for padding
|
| 408 |
+
if version.Version(torch.__version__) >= version.Version("1.2.0a"):
|
| 409 |
+
rmask = (1 - attention_mask).bool()
|
| 410 |
+
else:
|
| 411 |
+
rmask = (1 - attention_mask).byte()
|
| 412 |
+
|
| 413 |
+
# Zero out padding positions
|
| 414 |
+
out.masked_fill_(rmask.unsqueeze(-1).expand(out.size()), 0)
|
| 415 |
+
|
| 416 |
+
# Apply activation and dropout
|
| 417 |
+
out = self.activation(self.dropout(out))
|
| 418 |
+
|
| 419 |
+
# Residual connection with LayerNorm
|
| 420 |
+
output_states = masked_layer_norm(self.layer_norm, residual_states + out, attention_mask)
|
| 421 |
+
|
| 422 |
+
return output_states
|
| 423 |
+
|
| 424 |
+
|
| 425 |
+
class TransformerBlock(nn.Module):
|
| 426 |
+
"""Transformer block with disentangled attention and GELU FFN."""
|
| 427 |
+
|
| 428 |
+
def __init__(self, config: HELMBertConfig):
|
| 429 |
+
super().__init__()
|
| 430 |
+
|
| 431 |
+
self.self_attn = DisentangledSelfAttention(config)
|
| 432 |
+
self.attn_output_dense = nn.Linear(config.hidden_size, config.hidden_size)
|
| 433 |
+
|
| 434 |
+
# FFN with GELU
|
| 435 |
+
self.linear1 = nn.Sequential(
|
| 436 |
+
nn.Linear(config.hidden_size, config.intermediate_size), nn.GELU()
|
| 437 |
+
)
|
| 438 |
+
self.linear2 = nn.Linear(config.intermediate_size, config.hidden_size)
|
| 439 |
+
|
| 440 |
+
# Normalization and dropout
|
| 441 |
+
self.norm1 = nn.LayerNorm(config.hidden_size)
|
| 442 |
+
self.norm2 = nn.LayerNorm(config.hidden_size)
|
| 443 |
+
self.dropout1 = nn.Dropout(config.hidden_dropout_prob)
|
| 444 |
+
self.dropout2 = nn.Dropout(config.hidden_dropout_prob)
|
| 445 |
+
|
| 446 |
+
def forward(
|
| 447 |
+
self,
|
| 448 |
+
src: torch.Tensor,
|
| 449 |
+
src_key_padding_mask: Optional[torch.Tensor] = None,
|
| 450 |
+
output_attentions: bool = False,
|
| 451 |
+
query_states: Optional[torch.Tensor] = None,
|
| 452 |
+
relative_pos: Optional[torch.Tensor] = None,
|
| 453 |
+
rel_embeddings: Optional[torch.Tensor] = None,
|
| 454 |
+
) -> Tuple[torch.Tensor, Optional[torch.Tensor]]:
|
| 455 |
+
"""Forward pass.
|
| 456 |
+
|
| 457 |
+
Args:
|
| 458 |
+
src: Input embeddings [seq_len, batch, hidden]
|
| 459 |
+
src_key_padding_mask: Padding mask [batch, seq_len]
|
| 460 |
+
output_attentions: Whether to return attention weights
|
| 461 |
+
query_states: Optional query for EMD
|
| 462 |
+
relative_pos: Relative position indices
|
| 463 |
+
rel_embeddings: Relative position embeddings
|
| 464 |
+
|
| 465 |
+
Returns:
|
| 466 |
+
Tuple of (output, optional attention weights)
|
| 467 |
+
"""
|
| 468 |
+
# Transpose for attention [seq, batch, hidden] -> [batch, seq, hidden]
|
| 469 |
+
src_transposed = src.transpose(0, 1)
|
| 470 |
+
|
| 471 |
+
# Convert padding mask to attention mask (1=valid, 0=padding)
|
| 472 |
+
attention_mask = None
|
| 473 |
+
if src_key_padding_mask is not None:
|
| 474 |
+
attention_mask = (~src_key_padding_mask).float()
|
| 475 |
+
|
| 476 |
+
query_states_transposed = None
|
| 477 |
+
if query_states is not None:
|
| 478 |
+
query_states_transposed = query_states.transpose(0, 1)
|
| 479 |
+
|
| 480 |
+
# Self-attention
|
| 481 |
+
attn_result = self.self_attn(
|
| 482 |
+
src_transposed,
|
| 483 |
+
attention_mask,
|
| 484 |
+
output_attentions=output_attentions,
|
| 485 |
+
query_states=query_states_transposed,
|
| 486 |
+
relative_pos=relative_pos,
|
| 487 |
+
rel_embeddings=rel_embeddings,
|
| 488 |
+
)
|
| 489 |
+
attn_output = attn_result["hidden_states"].transpose(0, 1)
|
| 490 |
+
attn_weights = attn_result.get("attention_probs") if output_attentions else None
|
| 491 |
+
|
| 492 |
+
# Dense projection
|
| 493 |
+
attn_output = self.attn_output_dense(attn_output)
|
| 494 |
+
|
| 495 |
+
# Residual connection
|
| 496 |
+
residual_input = query_states if query_states is not None else src
|
| 497 |
+
src = residual_input + self.dropout1(attn_output)
|
| 498 |
+
|
| 499 |
+
# LayerNorm
|
| 500 |
+
src = src.transpose(0, 1)
|
| 501 |
+
src = masked_layer_norm(self.norm1, src)
|
| 502 |
+
src = src.transpose(0, 1)
|
| 503 |
+
|
| 504 |
+
# FFN
|
| 505 |
+
ff_output = self.linear1(src)
|
| 506 |
+
ff_output = self.linear2(ff_output)
|
| 507 |
+
ff_output = self.dropout2(ff_output)
|
| 508 |
+
src = src + ff_output
|
| 509 |
+
|
| 510 |
+
# LayerNorm
|
| 511 |
+
src = src.transpose(0, 1)
|
| 512 |
+
src = masked_layer_norm(self.norm2, src)
|
| 513 |
+
src = src.transpose(0, 1)
|
| 514 |
+
|
| 515 |
+
return src, attn_weights
|
| 516 |
+
|
| 517 |
+
|
| 518 |
+
class HELMBertEncoder(nn.Module):
|
| 519 |
+
"""Stack of transformer blocks with nGiE layer."""
|
| 520 |
+
|
| 521 |
+
def __init__(self, config: HELMBertConfig):
|
| 522 |
+
super().__init__()
|
| 523 |
+
self.config = config
|
| 524 |
+
|
| 525 |
+
# nGiE layer (applied after first transformer block)
|
| 526 |
+
self.ngie_layer = NgieLayer(config)
|
| 527 |
+
|
| 528 |
+
# Transformer blocks
|
| 529 |
+
self.layers = nn.ModuleList([TransformerBlock(config) for _ in range(config.num_hidden_layers)])
|
| 530 |
+
|
| 531 |
+
def get_rel_embedding(self) -> Optional[torch.Tensor]:
|
| 532 |
+
"""Get relative position embeddings from first layer."""
|
| 533 |
+
if len(self.layers) > 0:
|
| 534 |
+
first_layer = self.layers[0]
|
| 535 |
+
if hasattr(first_layer, "self_attn") and hasattr(first_layer.self_attn, "rel_embeddings"):
|
| 536 |
+
return first_layer.self_attn.rel_embeddings.weight
|
| 537 |
+
return None
|
| 538 |
+
|
| 539 |
+
def forward(
|
| 540 |
+
self,
|
| 541 |
+
hidden_states: torch.Tensor,
|
| 542 |
+
attention_mask: Optional[torch.Tensor] = None,
|
| 543 |
+
position_embeddings: Optional[torch.Tensor] = None,
|
| 544 |
+
output_attentions: bool = False,
|
| 545 |
+
output_hidden_states: bool = False,
|
| 546 |
+
use_emd: bool = False,
|
| 547 |
+
) -> Tuple[torch.Tensor, Optional[torch.Tensor], Optional[Tuple], Optional[Tuple]]:
|
| 548 |
+
"""Forward pass.
|
| 549 |
+
|
| 550 |
+
Args:
|
| 551 |
+
hidden_states: Input embeddings [batch, seq, hidden]
|
| 552 |
+
attention_mask: Attention mask [batch, seq]
|
| 553 |
+
position_embeddings: Position embeddings for EMD
|
| 554 |
+
output_attentions: Whether to return attention weights
|
| 555 |
+
output_hidden_states: Whether to return all hidden states
|
| 556 |
+
use_emd: Whether to use Enhanced Mask Decoder
|
| 557 |
+
|
| 558 |
+
Returns:
|
| 559 |
+
Tuple of (last_hidden_state, emd_output, all_hidden_states, all_attentions)
|
| 560 |
+
"""
|
| 561 |
+
all_hidden_states = () if output_hidden_states else None
|
| 562 |
+
all_attentions = () if output_attentions else None
|
| 563 |
+
|
| 564 |
+
# Store for nGiE
|
| 565 |
+
ngie_input_states = hidden_states.clone()
|
| 566 |
+
|
| 567 |
+
# [batch, seq, hidden] -> [seq, batch, hidden]
|
| 568 |
+
hidden_states = hidden_states.transpose(0, 1)
|
| 569 |
+
|
| 570 |
+
# Key padding mask (True = padding)
|
| 571 |
+
key_padding_mask = None
|
| 572 |
+
if attention_mask is not None:
|
| 573 |
+
key_padding_mask = ~attention_mask.bool()
|
| 574 |
+
|
| 575 |
+
# Store layer[-2] for EMD
|
| 576 |
+
layer_minus_2 = None
|
| 577 |
+
num_layers = len(self.layers)
|
| 578 |
+
|
| 579 |
+
for layer_idx, layer in enumerate(self.layers):
|
| 580 |
+
if output_hidden_states:
|
| 581 |
+
all_hidden_states = all_hidden_states + (hidden_states.transpose(0, 1),)
|
| 582 |
+
|
| 583 |
+
hidden_states, attn_weights = layer(
|
| 584 |
+
hidden_states,
|
| 585 |
+
src_key_padding_mask=key_padding_mask,
|
| 586 |
+
output_attentions=output_attentions,
|
| 587 |
+
)
|
| 588 |
+
|
| 589 |
+
if output_attentions and attn_weights is not None:
|
| 590 |
+
all_attentions = all_attentions + (attn_weights,)
|
| 591 |
+
|
| 592 |
+
# Apply nGiE after first layer
|
| 593 |
+
if layer_idx == 0:
|
| 594 |
+
hidden_states_batch = hidden_states.transpose(0, 1)
|
| 595 |
+
hidden_states_batch = self.ngie_layer(ngie_input_states, hidden_states_batch, attention_mask)
|
| 596 |
+
hidden_states = hidden_states_batch.transpose(0, 1)
|
| 597 |
+
|
| 598 |
+
# Store layer[-2] for EMD
|
| 599 |
+
if use_emd and layer_idx == num_layers - 2:
|
| 600 |
+
layer_minus_2 = hidden_states.clone()
|
| 601 |
+
|
| 602 |
+
# Convert back to [batch, seq, hidden]
|
| 603 |
+
hidden_states = hidden_states.transpose(0, 1)
|
| 604 |
+
|
| 605 |
+
if output_hidden_states:
|
| 606 |
+
all_hidden_states = all_hidden_states + (hidden_states,)
|
| 607 |
+
|
| 608 |
+
# Enhanced Mask Decoder (EMD) for MLM
|
| 609 |
+
emd_output = None
|
| 610 |
+
if use_emd and layer_minus_2 is not None and position_embeddings is not None:
|
| 611 |
+
emd_keys_values = layer_minus_2
|
| 612 |
+
emd_query = layer_minus_2.transpose(0, 1)
|
| 613 |
+
emd_query = position_embeddings + emd_query
|
| 614 |
+
emd_query = emd_query.transpose(0, 1)
|
| 615 |
+
|
| 616 |
+
rel_embeddings = self.get_rel_embedding()
|
| 617 |
+
last_layer = self.layers[-1]
|
| 618 |
+
|
| 619 |
+
for _ in range(2):
|
| 620 |
+
emd_query, _ = last_layer(
|
| 621 |
+
emd_keys_values,
|
| 622 |
+
src_key_padding_mask=key_padding_mask,
|
| 623 |
+
query_states=emd_query,
|
| 624 |
+
relative_pos=None,
|
| 625 |
+
rel_embeddings=rel_embeddings,
|
| 626 |
+
)
|
| 627 |
+
|
| 628 |
+
emd_output = emd_query.transpose(0, 1)
|
| 629 |
+
|
| 630 |
+
return hidden_states, emd_output, all_hidden_states, all_attentions
|
| 631 |
+
|
| 632 |
+
|
| 633 |
+
class HELMBertPooler(nn.Module):
|
| 634 |
+
"""Mean pooling over sequence."""
|
| 635 |
+
|
| 636 |
+
def __init__(self, config: HELMBertConfig):
|
| 637 |
+
super().__init__()
|
| 638 |
+
self.hidden_size = config.hidden_size
|
| 639 |
+
|
| 640 |
+
def forward(
|
| 641 |
+
self, hidden_states: torch.Tensor, attention_mask: Optional[torch.Tensor] = None
|
| 642 |
+
) -> torch.Tensor:
|
| 643 |
+
"""Apply mean pooling.
|
| 644 |
+
|
| 645 |
+
Args:
|
| 646 |
+
hidden_states: [batch, seq, hidden]
|
| 647 |
+
attention_mask: [batch, seq]
|
| 648 |
+
|
| 649 |
+
Returns:
|
| 650 |
+
Pooled output [batch, hidden]
|
| 651 |
+
"""
|
| 652 |
+
if attention_mask is not None:
|
| 653 |
+
mask_expanded = attention_mask.unsqueeze(-1).expand(hidden_states.size()).float()
|
| 654 |
+
sum_embeddings = torch.sum(hidden_states * mask_expanded, 1)
|
| 655 |
+
eps = torch.finfo(hidden_states.dtype).eps
|
| 656 |
+
sum_mask = torch.clamp(mask_expanded.sum(1), min=eps)
|
| 657 |
+
return sum_embeddings / sum_mask
|
| 658 |
+
else:
|
| 659 |
+
return hidden_states.mean(dim=1)
|
| 660 |
+
|
| 661 |
+
|
| 662 |
+
# -----------------------------------------------------------------------------
|
| 663 |
+
# Pre-trained Model Base
|
| 664 |
+
# -----------------------------------------------------------------------------
|
| 665 |
+
|
| 666 |
+
|
| 667 |
+
class HELMBertPreTrainedModel(PreTrainedModel):
|
| 668 |
+
"""Base class for HELM-BERT models."""
|
| 669 |
+
|
| 670 |
+
config_class = HELMBertConfig
|
| 671 |
+
base_model_prefix = "helmbert"
|
| 672 |
+
supports_gradient_checkpointing = True
|
| 673 |
+
|
| 674 |
+
def _init_weights(self, module: nn.Module) -> None:
|
| 675 |
+
"""Initialize weights with BERT-style initialization."""
|
| 676 |
+
if isinstance(module, nn.Linear):
|
| 677 |
+
nn.init.normal_(module.weight, mean=0.0, std=0.02)
|
| 678 |
+
if module.bias is not None:
|
| 679 |
+
nn.init.zeros_(module.bias)
|
| 680 |
+
elif isinstance(module, nn.Embedding):
|
| 681 |
+
nn.init.normal_(module.weight, mean=0.0, std=0.02)
|
| 682 |
+
if module.padding_idx is not None:
|
| 683 |
+
module.weight.data[module.padding_idx].zero_()
|
| 684 |
+
elif isinstance(module, nn.LayerNorm):
|
| 685 |
+
nn.init.ones_(module.weight)
|
| 686 |
+
nn.init.zeros_(module.bias)
|
| 687 |
+
|
| 688 |
+
|
| 689 |
+
# -----------------------------------------------------------------------------
|
| 690 |
+
# Model Classes
|
| 691 |
+
# -----------------------------------------------------------------------------
|
| 692 |
+
|
| 693 |
+
|
| 694 |
+
class HELMBertModel(HELMBertPreTrainedModel):
|
| 695 |
+
"""HELM-BERT base model.
|
| 696 |
+
|
| 697 |
+
This model outputs the last hidden states and optionally pooled output.
|
| 698 |
+
|
| 699 |
+
Example:
|
| 700 |
+
>>> from helmbert import HELMBertModel, HELMBertTokenizer
|
| 701 |
+
>>> tokenizer = HELMBertTokenizer()
|
| 702 |
+
>>> model = HELMBertModel.from_pretrained("./checkpoints/helmbert-base")
|
| 703 |
+
>>> inputs = tokenizer("PEPTIDE1{A.C.D.E}$$$$", return_tensors="pt")
|
| 704 |
+
>>> outputs = model(**inputs)
|
| 705 |
+
>>> last_hidden_state = outputs.last_hidden_state
|
| 706 |
+
>>> pooler_output = outputs.pooler_output
|
| 707 |
+
"""
|
| 708 |
+
|
| 709 |
+
def __init__(self, config: HELMBertConfig):
|
| 710 |
+
super().__init__(config)
|
| 711 |
+
self.config = config
|
| 712 |
+
|
| 713 |
+
self.embeddings = HELMBertEmbeddings(config)
|
| 714 |
+
self.encoder = HELMBertEncoder(config)
|
| 715 |
+
self.pooler = HELMBertPooler(config)
|
| 716 |
+
|
| 717 |
+
self.post_init()
|
| 718 |
+
|
| 719 |
+
def get_input_embeddings(self) -> nn.Embedding:
|
| 720 |
+
return self.embeddings.word_embeddings
|
| 721 |
+
|
| 722 |
+
def set_input_embeddings(self, value: nn.Embedding) -> None:
|
| 723 |
+
self.embeddings.word_embeddings = value
|
| 724 |
+
|
| 725 |
+
def forward(
|
| 726 |
+
self,
|
| 727 |
+
input_ids: torch.Tensor,
|
| 728 |
+
attention_mask: Optional[torch.Tensor] = None,
|
| 729 |
+
output_attentions: bool = False,
|
| 730 |
+
output_hidden_states: bool = False,
|
| 731 |
+
return_dict: bool = True,
|
| 732 |
+
) -> Union[Tuple, BaseModelOutputWithPooling]:
|
| 733 |
+
"""Forward pass.
|
| 734 |
+
|
| 735 |
+
Args:
|
| 736 |
+
input_ids: Token IDs [batch, seq]
|
| 737 |
+
attention_mask: Attention mask [batch, seq]
|
| 738 |
+
output_attentions: Whether to return attention weights
|
| 739 |
+
output_hidden_states: Whether to return all hidden states
|
| 740 |
+
return_dict: Whether to return a ModelOutput
|
| 741 |
+
|
| 742 |
+
Returns:
|
| 743 |
+
BaseModelOutputWithPooling or tuple
|
| 744 |
+
"""
|
| 745 |
+
if attention_mask is None:
|
| 746 |
+
attention_mask = torch.ones_like(input_ids)
|
| 747 |
+
|
| 748 |
+
# Embeddings
|
| 749 |
+
embeddings, position_embeddings = self.embeddings(input_ids, attention_mask)
|
| 750 |
+
|
| 751 |
+
# Encoder
|
| 752 |
+
encoder_outputs = self.encoder(
|
| 753 |
+
embeddings,
|
| 754 |
+
attention_mask=attention_mask,
|
| 755 |
+
position_embeddings=position_embeddings,
|
| 756 |
+
output_attentions=output_attentions,
|
| 757 |
+
output_hidden_states=output_hidden_states,
|
| 758 |
+
use_emd=False,
|
| 759 |
+
)
|
| 760 |
+
|
| 761 |
+
last_hidden_state = encoder_outputs[0]
|
| 762 |
+
hidden_states = encoder_outputs[2]
|
| 763 |
+
attentions = encoder_outputs[3]
|
| 764 |
+
|
| 765 |
+
# Pooling
|
| 766 |
+
pooler_output = self.pooler(last_hidden_state, attention_mask)
|
| 767 |
+
|
| 768 |
+
if not return_dict:
|
| 769 |
+
return (last_hidden_state, pooler_output, hidden_states, attentions)
|
| 770 |
+
|
| 771 |
+
return BaseModelOutputWithPooling(
|
| 772 |
+
last_hidden_state=last_hidden_state,
|
| 773 |
+
pooler_output=pooler_output,
|
| 774 |
+
hidden_states=hidden_states,
|
| 775 |
+
attentions=attentions,
|
| 776 |
+
)
|
| 777 |
+
|
| 778 |
+
|
| 779 |
+
class HELMBertLMHead(nn.Module):
|
| 780 |
+
"""MLM head with weight tying."""
|
| 781 |
+
|
| 782 |
+
def __init__(self, config: HELMBertConfig):
|
| 783 |
+
super().__init__()
|
| 784 |
+
self.dense = nn.Linear(config.hidden_size, config.hidden_size)
|
| 785 |
+
self.layer_norm = nn.LayerNorm(config.hidden_size)
|
| 786 |
+
self.activation = nn.GELU()
|
| 787 |
+
self.decoder = nn.Linear(config.hidden_size, config.vocab_size, bias=True)
|
| 788 |
+
|
| 789 |
+
def forward(self, hidden_states: torch.Tensor) -> torch.Tensor:
|
| 790 |
+
"""Forward pass.
|
| 791 |
+
|
| 792 |
+
Args:
|
| 793 |
+
hidden_states: [batch, seq, hidden]
|
| 794 |
+
|
| 795 |
+
Returns:
|
| 796 |
+
Logits [batch, seq, vocab]
|
| 797 |
+
"""
|
| 798 |
+
hidden_states = self.dense(hidden_states)
|
| 799 |
+
hidden_states = self.activation(hidden_states)
|
| 800 |
+
hidden_states = self.layer_norm(hidden_states)
|
| 801 |
+
logits = self.decoder(hidden_states)
|
| 802 |
+
return logits
|
| 803 |
+
|
| 804 |
+
|
| 805 |
+
class HELMBertForMaskedLM(HELMBertPreTrainedModel):
|
| 806 |
+
"""HELM-BERT for Masked Language Modeling with Enhanced Mask Decoder (EMD).
|
| 807 |
+
|
| 808 |
+
Example:
|
| 809 |
+
>>> from helmbert import HELMBertForMaskedLM, HELMBertTokenizer
|
| 810 |
+
>>> tokenizer = HELMBertTokenizer()
|
| 811 |
+
>>> model = HELMBertForMaskedLM.from_pretrained("./checkpoints/helmbert-base")
|
| 812 |
+
>>> inputs = tokenizer("PEPTIDE1{A.¶.D.E}$$$$", return_tensors="pt") # ¶ is mask
|
| 813 |
+
>>> outputs = model(**inputs)
|
| 814 |
+
>>> predictions = outputs.logits.argmax(dim=-1)
|
| 815 |
+
"""
|
| 816 |
+
|
| 817 |
+
_tied_weights_keys = ["lm_head.decoder.weight", "lm_head.decoder.bias"]
|
| 818 |
+
|
| 819 |
+
def __init__(self, config: HELMBertConfig):
|
| 820 |
+
super().__init__(config)
|
| 821 |
+
self.helmbert = HELMBertModel(config)
|
| 822 |
+
self.lm_head = HELMBertLMHead(config)
|
| 823 |
+
|
| 824 |
+
self.post_init()
|
| 825 |
+
|
| 826 |
+
def get_output_embeddings(self) -> nn.Linear:
|
| 827 |
+
return self.lm_head.decoder
|
| 828 |
+
|
| 829 |
+
def set_output_embeddings(self, new_embeddings: nn.Linear) -> None:
|
| 830 |
+
self.lm_head.decoder = new_embeddings
|
| 831 |
+
|
| 832 |
+
def forward(
|
| 833 |
+
self,
|
| 834 |
+
input_ids: torch.Tensor,
|
| 835 |
+
attention_mask: Optional[torch.Tensor] = None,
|
| 836 |
+
labels: Optional[torch.Tensor] = None,
|
| 837 |
+
output_attentions: bool = False,
|
| 838 |
+
output_hidden_states: bool = False,
|
| 839 |
+
return_dict: bool = True,
|
| 840 |
+
use_emd: bool = True,
|
| 841 |
+
) -> Union[Tuple, MaskedLMOutput]:
|
| 842 |
+
"""Forward pass.
|
| 843 |
+
|
| 844 |
+
Args:
|
| 845 |
+
input_ids: Token IDs [batch, seq]
|
| 846 |
+
attention_mask: Attention mask [batch, seq]
|
| 847 |
+
labels: Labels for MLM (-100 for non-masked tokens)
|
| 848 |
+
output_attentions: Whether to return attention weights
|
| 849 |
+
output_hidden_states: Whether to return all hidden states
|
| 850 |
+
return_dict: Whether to return a ModelOutput
|
| 851 |
+
use_emd: Whether to use Enhanced Mask Decoder
|
| 852 |
+
|
| 853 |
+
Returns:
|
| 854 |
+
MaskedLMOutput or tuple
|
| 855 |
+
"""
|
| 856 |
+
if attention_mask is None:
|
| 857 |
+
attention_mask = torch.ones_like(input_ids)
|
| 858 |
+
|
| 859 |
+
# Embeddings
|
| 860 |
+
embeddings, position_embeddings = self.helmbert.embeddings(input_ids, attention_mask)
|
| 861 |
+
|
| 862 |
+
# Encoder with optional EMD
|
| 863 |
+
encoder_outputs = self.helmbert.encoder(
|
| 864 |
+
embeddings,
|
| 865 |
+
attention_mask=attention_mask,
|
| 866 |
+
position_embeddings=position_embeddings,
|
| 867 |
+
output_attentions=output_attentions,
|
| 868 |
+
output_hidden_states=output_hidden_states,
|
| 869 |
+
use_emd=use_emd,
|
| 870 |
+
)
|
| 871 |
+
|
| 872 |
+
# Use EMD output if available, otherwise use last hidden state
|
| 873 |
+
if use_emd and encoder_outputs[1] is not None:
|
| 874 |
+
sequence_output = encoder_outputs[1]
|
| 875 |
+
else:
|
| 876 |
+
sequence_output = encoder_outputs[0]
|
| 877 |
+
|
| 878 |
+
hidden_states = encoder_outputs[2]
|
| 879 |
+
attentions = encoder_outputs[3]
|
| 880 |
+
|
| 881 |
+
# MLM head
|
| 882 |
+
prediction_scores = self.lm_head(sequence_output)
|
| 883 |
+
|
| 884 |
+
# Calculate loss if labels provided
|
| 885 |
+
loss = None
|
| 886 |
+
if labels is not None:
|
| 887 |
+
loss_fct = nn.CrossEntropyLoss(ignore_index=-100)
|
| 888 |
+
loss = loss_fct(prediction_scores.view(-1, self.config.vocab_size), labels.view(-1))
|
| 889 |
+
|
| 890 |
+
if not return_dict:
|
| 891 |
+
output = (prediction_scores, hidden_states, attentions)
|
| 892 |
+
return ((loss,) + output) if loss is not None else output
|
| 893 |
+
|
| 894 |
+
return MaskedLMOutput(
|
| 895 |
+
loss=loss,
|
| 896 |
+
logits=prediction_scores,
|
| 897 |
+
hidden_states=hidden_states,
|
| 898 |
+
attentions=attentions,
|
| 899 |
+
)
|
| 900 |
+
|
| 901 |
+
|
| 902 |
+
class HELMBertForSequenceClassification(HELMBertPreTrainedModel):
|
| 903 |
+
"""HELM-BERT for sequence classification/regression.
|
| 904 |
+
|
| 905 |
+
Example:
|
| 906 |
+
>>> from helmbert import HELMBertForSequenceClassification, HELMBertConfig
|
| 907 |
+
>>> config = HELMBertConfig(num_labels=1) # Regression
|
| 908 |
+
>>> model = HELMBertForSequenceClassification(config)
|
| 909 |
+
"""
|
| 910 |
+
|
| 911 |
+
def __init__(self, config: HELMBertConfig):
|
| 912 |
+
super().__init__(config)
|
| 913 |
+
self.num_labels = config.num_labels
|
| 914 |
+
self.config = config
|
| 915 |
+
|
| 916 |
+
self.helmbert = HELMBertModel(config)
|
| 917 |
+
self.dropout = nn.Dropout(config.hidden_dropout_prob)
|
| 918 |
+
self.classifier = nn.Linear(config.hidden_size, config.num_labels)
|
| 919 |
+
|
| 920 |
+
self.post_init()
|
| 921 |
+
|
| 922 |
+
def forward(
|
| 923 |
+
self,
|
| 924 |
+
input_ids: torch.Tensor,
|
| 925 |
+
attention_mask: Optional[torch.Tensor] = None,
|
| 926 |
+
labels: Optional[torch.Tensor] = None,
|
| 927 |
+
output_attentions: bool = False,
|
| 928 |
+
output_hidden_states: bool = False,
|
| 929 |
+
return_dict: bool = True,
|
| 930 |
+
) -> Union[Tuple, SequenceClassifierOutput]:
|
| 931 |
+
"""Forward pass.
|
| 932 |
+
|
| 933 |
+
Args:
|
| 934 |
+
input_ids: Token IDs [batch, seq]
|
| 935 |
+
attention_mask: Attention mask [batch, seq]
|
| 936 |
+
labels: Labels for classification/regression
|
| 937 |
+
output_attentions: Whether to return attention weights
|
| 938 |
+
output_hidden_states: Whether to return all hidden states
|
| 939 |
+
return_dict: Whether to return a ModelOutput
|
| 940 |
+
|
| 941 |
+
Returns:
|
| 942 |
+
SequenceClassifierOutput or tuple
|
| 943 |
+
"""
|
| 944 |
+
outputs = self.helmbert(
|
| 945 |
+
input_ids,
|
| 946 |
+
attention_mask=attention_mask,
|
| 947 |
+
output_attentions=output_attentions,
|
| 948 |
+
output_hidden_states=output_hidden_states,
|
| 949 |
+
return_dict=True,
|
| 950 |
+
)
|
| 951 |
+
|
| 952 |
+
pooled_output = outputs.pooler_output
|
| 953 |
+
pooled_output = self.dropout(pooled_output)
|
| 954 |
+
logits = self.classifier(pooled_output)
|
| 955 |
+
|
| 956 |
+
loss = None
|
| 957 |
+
if labels is not None:
|
| 958 |
+
if self.config.problem_type is None:
|
| 959 |
+
if self.num_labels == 1:
|
| 960 |
+
self.config.problem_type = "regression"
|
| 961 |
+
elif self.num_labels > 1 and (labels.dtype == torch.long or labels.dtype == torch.int):
|
| 962 |
+
self.config.problem_type = "single_label_classification"
|
| 963 |
+
else:
|
| 964 |
+
self.config.problem_type = "multi_label_classification"
|
| 965 |
+
|
| 966 |
+
if self.config.problem_type == "regression":
|
| 967 |
+
loss_fct = nn.MSELoss()
|
| 968 |
+
if self.num_labels == 1:
|
| 969 |
+
loss = loss_fct(logits.squeeze(), labels.squeeze())
|
| 970 |
+
else:
|
| 971 |
+
loss = loss_fct(logits, labels)
|
| 972 |
+
elif self.config.problem_type == "single_label_classification":
|
| 973 |
+
loss_fct = nn.CrossEntropyLoss()
|
| 974 |
+
loss = loss_fct(logits.view(-1, self.num_labels), labels.view(-1))
|
| 975 |
+
elif self.config.problem_type == "multi_label_classification":
|
| 976 |
+
loss_fct = nn.BCEWithLogitsLoss()
|
| 977 |
+
loss = loss_fct(logits, labels)
|
| 978 |
+
|
| 979 |
+
if not return_dict:
|
| 980 |
+
output = (logits,) + outputs[2:]
|
| 981 |
+
return ((loss,) + output) if loss is not None else output
|
| 982 |
+
|
| 983 |
+
return SequenceClassifierOutput(
|
| 984 |
+
loss=loss,
|
| 985 |
+
logits=logits,
|
| 986 |
+
hidden_states=outputs.hidden_states,
|
| 987 |
+
attentions=outputs.attentions,
|
| 988 |
+
)
|
special_tokens_map.json
ADDED
|
@@ -0,0 +1,9 @@
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
| 1 |
+
{
|
| 2 |
+
"bos_token": "@",
|
| 3 |
+
"cls_token": "@",
|
| 4 |
+
"eos_token": "\n",
|
| 5 |
+
"mask_token": "¶",
|
| 6 |
+
"pad_token": " ",
|
| 7 |
+
"sep_token": "\n",
|
| 8 |
+
"unk_token": "§"
|
| 9 |
+
}
|
tokenization_helmbert.py
ADDED
|
@@ -0,0 +1,285 @@
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
| 1 |
+
"""HELM-BERT tokenizer."""
|
| 2 |
+
|
| 3 |
+
import json
|
| 4 |
+
import os
|
| 5 |
+
from typing import Dict, List, Optional, Tuple, Union
|
| 6 |
+
|
| 7 |
+
from transformers import PreTrainedTokenizer
|
| 8 |
+
|
| 9 |
+
|
| 10 |
+
# Default vocabulary for HELM notation
|
| 11 |
+
HELM_VOCAB = {
|
| 12 |
+
# Special tokens (0-4)
|
| 13 |
+
" ": 0, # PAD
|
| 14 |
+
"@": 1, # BOS/CLS
|
| 15 |
+
"\n": 2, # EOS/SEP
|
| 16 |
+
"§": 3, # UNK
|
| 17 |
+
"¶": 4, # MASK
|
| 18 |
+
|
| 19 |
+
# Natural amino acids (5-25)
|
| 20 |
+
"A": 5, "R": 6, "N": 7, "D": 8, "C": 9,
|
| 21 |
+
"E": 10, "Q": 11, "G": 12, "H": 13, "I": 14,
|
| 22 |
+
"L": 15, "K": 16, "M": 17, "F": 18, "P": 19,
|
| 23 |
+
"S": 20, "T": 21, "W": 22, "Y": 23, "V": 24,
|
| 24 |
+
"X": 25, # Unknown amino acid
|
| 25 |
+
|
| 26 |
+
# Structure symbols (26-37)
|
| 27 |
+
"[": 26, "]": 27, "{": 28, "}": 29, "(": 30, ")": 31,
|
| 28 |
+
"$": 32, ",": 33, ":": 34, "|": 35, "-": 36, ".": 37,
|
| 29 |
+
|
| 30 |
+
# Numbers (38-47)
|
| 31 |
+
"0": 38, "1": 39, "2": 40, "3": 41, "4": 42,
|
| 32 |
+
"5": 43, "6": 44, "7": 45, "8": 46, "9": 47,
|
| 33 |
+
|
| 34 |
+
# Uppercase non-amino acids (48-50)
|
| 35 |
+
"B": 48, "O": 49, ">": 50,
|
| 36 |
+
|
| 37 |
+
# Lowercase letters (51-72)
|
| 38 |
+
"a": 51, "b": 52, "c": 53, "d": 54, "e": 55,
|
| 39 |
+
"f": 56, "g": 57, "h": 58, "i": 59, "l": 60,
|
| 40 |
+
"m": 61, "n": 62, "o": 63, "p": 64, "r": 65,
|
| 41 |
+
"s": 66, "t": 67, "u": 68, "v": 69, "x": 70,
|
| 42 |
+
"y": 71, "z": 72,
|
| 43 |
+
|
| 44 |
+
# Encoded polymer markers (73-76)
|
| 45 |
+
"/": 73, # PEPTIDE
|
| 46 |
+
"*": 74, # me
|
| 47 |
+
"\t": 75, # am
|
| 48 |
+
"&": 76, # ac
|
| 49 |
+
|
| 50 |
+
# Miscellaneous (77)
|
| 51 |
+
"_": 77,
|
| 52 |
+
}
|
| 53 |
+
|
| 54 |
+
# Multi-character to single-character encoding
|
| 55 |
+
HELM_ENCODE_MAP = {"PEPTIDE": "/", "me": "*", "am": "\t", "ac": "&"}
|
| 56 |
+
HELM_DECODE_MAP = {v: k for k, v in HELM_ENCODE_MAP.items()}
|
| 57 |
+
|
| 58 |
+
|
| 59 |
+
class HELMBertTokenizer(PreTrainedTokenizer):
|
| 60 |
+
"""Tokenizer for HELM-BERT.
|
| 61 |
+
|
| 62 |
+
This tokenizer handles HELM (Hierarchical Editing Language for Macromolecules)
|
| 63 |
+
notation, converting peptide sequences into token IDs for the HELM-BERT model.
|
| 64 |
+
|
| 65 |
+
The tokenizer uses character-level tokenization with special handling for
|
| 66 |
+
multi-character HELM tokens like "PEPTIDE", "me", "am", "ac".
|
| 67 |
+
|
| 68 |
+
Example:
|
| 69 |
+
>>> from helmbert import HELMBertTokenizer
|
| 70 |
+
>>> tokenizer = HELMBertTokenizer()
|
| 71 |
+
>>> inputs = tokenizer("PEPTIDE1{A.C.D.E}$$$$", return_tensors="pt")
|
| 72 |
+
>>> inputs.input_ids
|
| 73 |
+
tensor([[ 1, 73, 39, 28, 5, 37, 9, 37, 8, 37, 10, 29, 32, 32, 32, 32, 2]])
|
| 74 |
+
"""
|
| 75 |
+
|
| 76 |
+
vocab_files_names = {"vocab_file": "vocab.json"}
|
| 77 |
+
model_input_names = ["input_ids", "attention_mask"]
|
| 78 |
+
|
| 79 |
+
def __init__(
|
| 80 |
+
self,
|
| 81 |
+
vocab_file: Optional[str] = None,
|
| 82 |
+
unk_token: str = "§",
|
| 83 |
+
sep_token: str = "\n",
|
| 84 |
+
pad_token: str = " ",
|
| 85 |
+
cls_token: str = "@",
|
| 86 |
+
mask_token: str = "¶",
|
| 87 |
+
bos_token: str = "@",
|
| 88 |
+
eos_token: str = "\n",
|
| 89 |
+
model_max_length: int = 512,
|
| 90 |
+
**kwargs,
|
| 91 |
+
):
|
| 92 |
+
# Load or create vocabulary
|
| 93 |
+
if vocab_file is not None and os.path.isfile(vocab_file):
|
| 94 |
+
with open(vocab_file, encoding="utf-8") as f:
|
| 95 |
+
self.vocab = json.load(f)
|
| 96 |
+
else:
|
| 97 |
+
self.vocab = HELM_VOCAB.copy()
|
| 98 |
+
|
| 99 |
+
self.ids_to_tokens = {v: k for k, v in self.vocab.items()}
|
| 100 |
+
|
| 101 |
+
# HELM encoding/decoding maps
|
| 102 |
+
self.encode_map = HELM_ENCODE_MAP.copy()
|
| 103 |
+
self.decode_map = HELM_DECODE_MAP.copy()
|
| 104 |
+
|
| 105 |
+
super().__init__(
|
| 106 |
+
unk_token=unk_token,
|
| 107 |
+
sep_token=sep_token,
|
| 108 |
+
pad_token=pad_token,
|
| 109 |
+
cls_token=cls_token,
|
| 110 |
+
mask_token=mask_token,
|
| 111 |
+
bos_token=bos_token,
|
| 112 |
+
eos_token=eos_token,
|
| 113 |
+
model_max_length=model_max_length,
|
| 114 |
+
**kwargs,
|
| 115 |
+
)
|
| 116 |
+
|
| 117 |
+
@property
|
| 118 |
+
def vocab_size(self) -> int:
|
| 119 |
+
"""Return the vocabulary size."""
|
| 120 |
+
return len(self.vocab)
|
| 121 |
+
|
| 122 |
+
def get_vocab(self) -> Dict[str, int]:
|
| 123 |
+
"""Return the vocabulary as a dictionary."""
|
| 124 |
+
return self.vocab.copy()
|
| 125 |
+
|
| 126 |
+
def _encode_helm(self, text: str) -> str:
|
| 127 |
+
"""Encode multi-character HELM tokens to single characters.
|
| 128 |
+
|
| 129 |
+
Args:
|
| 130 |
+
text: Raw HELM notation string
|
| 131 |
+
|
| 132 |
+
Returns:
|
| 133 |
+
Encoded string with single-character tokens
|
| 134 |
+
"""
|
| 135 |
+
if not text:
|
| 136 |
+
return ""
|
| 137 |
+
result = text
|
| 138 |
+
for seq, tok in self.encode_map.items():
|
| 139 |
+
result = result.replace(seq, tok)
|
| 140 |
+
return result
|
| 141 |
+
|
| 142 |
+
def _decode_helm(self, text: str) -> str:
|
| 143 |
+
"""Decode single-character tokens back to multi-character HELM tokens.
|
| 144 |
+
|
| 145 |
+
Args:
|
| 146 |
+
text: Encoded string with single-character tokens
|
| 147 |
+
|
| 148 |
+
Returns:
|
| 149 |
+
Decoded HELM notation string
|
| 150 |
+
"""
|
| 151 |
+
if not text:
|
| 152 |
+
return ""
|
| 153 |
+
result = text
|
| 154 |
+
for tok, seq in self.decode_map.items():
|
| 155 |
+
result = result.replace(tok, seq)
|
| 156 |
+
return result
|
| 157 |
+
|
| 158 |
+
def _tokenize(self, text: str) -> List[str]:
|
| 159 |
+
"""Tokenize a HELM string into a list of tokens.
|
| 160 |
+
|
| 161 |
+
Args:
|
| 162 |
+
text: HELM notation string
|
| 163 |
+
|
| 164 |
+
Returns:
|
| 165 |
+
List of single-character tokens
|
| 166 |
+
"""
|
| 167 |
+
# First encode multi-character tokens to single characters
|
| 168 |
+
encoded = self._encode_helm(text)
|
| 169 |
+
# Return as list of characters
|
| 170 |
+
return list(encoded)
|
| 171 |
+
|
| 172 |
+
def _convert_token_to_id(self, token: str) -> int:
|
| 173 |
+
"""Convert a token to its ID."""
|
| 174 |
+
return self.vocab.get(token, self.vocab.get(self.unk_token, 3))
|
| 175 |
+
|
| 176 |
+
def _convert_id_to_token(self, index: int) -> str:
|
| 177 |
+
"""Convert an ID to its token."""
|
| 178 |
+
return self.ids_to_tokens.get(index, self.unk_token)
|
| 179 |
+
|
| 180 |
+
def convert_tokens_to_string(self, tokens: List[str]) -> str:
|
| 181 |
+
"""Convert a list of tokens to a HELM string.
|
| 182 |
+
|
| 183 |
+
Args:
|
| 184 |
+
tokens: List of tokens
|
| 185 |
+
|
| 186 |
+
Returns:
|
| 187 |
+
Decoded HELM notation string
|
| 188 |
+
"""
|
| 189 |
+
# Join tokens and decode back to HELM notation
|
| 190 |
+
joined = "".join(tokens)
|
| 191 |
+
return self._decode_helm(joined)
|
| 192 |
+
|
| 193 |
+
def build_inputs_with_special_tokens(
|
| 194 |
+
self, token_ids_0: List[int], token_ids_1: Optional[List[int]] = None
|
| 195 |
+
) -> List[int]:
|
| 196 |
+
"""Build model inputs by adding special tokens.
|
| 197 |
+
|
| 198 |
+
Args:
|
| 199 |
+
token_ids_0: First sequence of token IDs
|
| 200 |
+
token_ids_1: Optional second sequence of token IDs
|
| 201 |
+
|
| 202 |
+
Returns:
|
| 203 |
+
List of token IDs with special tokens added
|
| 204 |
+
"""
|
| 205 |
+
cls_id = [self.cls_token_id]
|
| 206 |
+
sep_id = [self.sep_token_id]
|
| 207 |
+
|
| 208 |
+
if token_ids_1 is None:
|
| 209 |
+
return cls_id + token_ids_0 + sep_id
|
| 210 |
+
|
| 211 |
+
return cls_id + token_ids_0 + sep_id + token_ids_1 + sep_id
|
| 212 |
+
|
| 213 |
+
def get_special_tokens_mask(
|
| 214 |
+
self,
|
| 215 |
+
token_ids_0: List[int],
|
| 216 |
+
token_ids_1: Optional[List[int]] = None,
|
| 217 |
+
already_has_special_tokens: bool = False,
|
| 218 |
+
) -> List[int]:
|
| 219 |
+
"""Get a mask identifying special tokens.
|
| 220 |
+
|
| 221 |
+
Args:
|
| 222 |
+
token_ids_0: First sequence of token IDs
|
| 223 |
+
token_ids_1: Optional second sequence of token IDs
|
| 224 |
+
already_has_special_tokens: Whether the sequences already have special tokens
|
| 225 |
+
|
| 226 |
+
Returns:
|
| 227 |
+
List of 0s and 1s (1 = special token)
|
| 228 |
+
"""
|
| 229 |
+
if already_has_special_tokens:
|
| 230 |
+
return [1 if x in [self.cls_token_id, self.sep_token_id, self.pad_token_id] else 0 for x in token_ids_0]
|
| 231 |
+
|
| 232 |
+
if token_ids_1 is None:
|
| 233 |
+
return [1] + [0] * len(token_ids_0) + [1]
|
| 234 |
+
|
| 235 |
+
return [1] + [0] * len(token_ids_0) + [1] + [0] * len(token_ids_1) + [1]
|
| 236 |
+
|
| 237 |
+
def create_token_type_ids_from_sequences(
|
| 238 |
+
self, token_ids_0: List[int], token_ids_1: Optional[List[int]] = None
|
| 239 |
+
) -> List[int]:
|
| 240 |
+
"""Create token type IDs for sequence pairs.
|
| 241 |
+
|
| 242 |
+
Args:
|
| 243 |
+
token_ids_0: First sequence of token IDs
|
| 244 |
+
token_ids_1: Optional second sequence of token IDs
|
| 245 |
+
|
| 246 |
+
Returns:
|
| 247 |
+
List of token type IDs
|
| 248 |
+
"""
|
| 249 |
+
sep = [self.sep_token_id]
|
| 250 |
+
cls = [self.cls_token_id]
|
| 251 |
+
|
| 252 |
+
if token_ids_1 is None:
|
| 253 |
+
return [0] * len(cls + token_ids_0 + sep)
|
| 254 |
+
|
| 255 |
+
return [0] * len(cls + token_ids_0 + sep) + [1] * len(token_ids_1 + sep)
|
| 256 |
+
|
| 257 |
+
def save_vocabulary(
|
| 258 |
+
self, save_directory: str, filename_prefix: Optional[str] = None
|
| 259 |
+
) -> Tuple[str]:
|
| 260 |
+
"""Save the vocabulary to a file.
|
| 261 |
+
|
| 262 |
+
Args:
|
| 263 |
+
save_directory: Directory to save the vocabulary
|
| 264 |
+
filename_prefix: Optional prefix for the filename
|
| 265 |
+
|
| 266 |
+
Returns:
|
| 267 |
+
Tuple containing the path to the saved vocabulary file
|
| 268 |
+
"""
|
| 269 |
+
if not os.path.isdir(save_directory):
|
| 270 |
+
os.makedirs(save_directory, exist_ok=True)
|
| 271 |
+
|
| 272 |
+
vocab_file = os.path.join(
|
| 273 |
+
save_directory,
|
| 274 |
+
(filename_prefix + "-" if filename_prefix else "") + "vocab.json",
|
| 275 |
+
)
|
| 276 |
+
|
| 277 |
+
with open(vocab_file, "w", encoding="utf-8") as f:
|
| 278 |
+
json.dump(self.vocab, f, ensure_ascii=False, indent=2)
|
| 279 |
+
|
| 280 |
+
return (vocab_file,)
|
| 281 |
+
|
| 282 |
+
@property
|
| 283 |
+
def mask_token_id(self) -> int:
|
| 284 |
+
"""Return the mask token ID."""
|
| 285 |
+
return self.vocab.get(self.mask_token, 4)
|
tokenizer_config.json
ADDED
|
@@ -0,0 +1,58 @@
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
| 1 |
+
{
|
| 2 |
+
"auto_map": {
|
| 3 |
+
"AutoTokenizer": ["tokenization_helmbert.HELMBertTokenizer", null]
|
| 4 |
+
},
|
| 5 |
+
"added_tokens_decoder": {
|
| 6 |
+
"0": {
|
| 7 |
+
"content": " ",
|
| 8 |
+
"lstrip": false,
|
| 9 |
+
"normalized": false,
|
| 10 |
+
"rstrip": false,
|
| 11 |
+
"single_word": false,
|
| 12 |
+
"special": true
|
| 13 |
+
},
|
| 14 |
+
"1": {
|
| 15 |
+
"content": "@",
|
| 16 |
+
"lstrip": false,
|
| 17 |
+
"normalized": false,
|
| 18 |
+
"rstrip": false,
|
| 19 |
+
"single_word": false,
|
| 20 |
+
"special": true
|
| 21 |
+
},
|
| 22 |
+
"2": {
|
| 23 |
+
"content": "\n",
|
| 24 |
+
"lstrip": false,
|
| 25 |
+
"normalized": false,
|
| 26 |
+
"rstrip": false,
|
| 27 |
+
"single_word": false,
|
| 28 |
+
"special": true
|
| 29 |
+
},
|
| 30 |
+
"3": {
|
| 31 |
+
"content": "§",
|
| 32 |
+
"lstrip": false,
|
| 33 |
+
"normalized": false,
|
| 34 |
+
"rstrip": false,
|
| 35 |
+
"single_word": false,
|
| 36 |
+
"special": true
|
| 37 |
+
},
|
| 38 |
+
"4": {
|
| 39 |
+
"content": "¶",
|
| 40 |
+
"lstrip": false,
|
| 41 |
+
"normalized": false,
|
| 42 |
+
"rstrip": false,
|
| 43 |
+
"single_word": false,
|
| 44 |
+
"special": true
|
| 45 |
+
}
|
| 46 |
+
},
|
| 47 |
+
"bos_token": "@",
|
| 48 |
+
"clean_up_tokenization_spaces": false,
|
| 49 |
+
"cls_token": "@",
|
| 50 |
+
"eos_token": "\n",
|
| 51 |
+
"extra_special_tokens": {},
|
| 52 |
+
"mask_token": "¶",
|
| 53 |
+
"model_max_length": 512,
|
| 54 |
+
"pad_token": " ",
|
| 55 |
+
"sep_token": "\n",
|
| 56 |
+
"tokenizer_class": "HELMBertTokenizer",
|
| 57 |
+
"unk_token": "§"
|
| 58 |
+
}
|
vocab.json
ADDED
|
@@ -0,0 +1,80 @@
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
| 1 |
+
{
|
| 2 |
+
" ": 0,
|
| 3 |
+
"@": 1,
|
| 4 |
+
"\n": 2,
|
| 5 |
+
"§": 3,
|
| 6 |
+
"¶": 4,
|
| 7 |
+
"A": 5,
|
| 8 |
+
"R": 6,
|
| 9 |
+
"N": 7,
|
| 10 |
+
"D": 8,
|
| 11 |
+
"C": 9,
|
| 12 |
+
"E": 10,
|
| 13 |
+
"Q": 11,
|
| 14 |
+
"G": 12,
|
| 15 |
+
"H": 13,
|
| 16 |
+
"I": 14,
|
| 17 |
+
"L": 15,
|
| 18 |
+
"K": 16,
|
| 19 |
+
"M": 17,
|
| 20 |
+
"F": 18,
|
| 21 |
+
"P": 19,
|
| 22 |
+
"S": 20,
|
| 23 |
+
"T": 21,
|
| 24 |
+
"W": 22,
|
| 25 |
+
"Y": 23,
|
| 26 |
+
"V": 24,
|
| 27 |
+
"X": 25,
|
| 28 |
+
"[": 26,
|
| 29 |
+
"]": 27,
|
| 30 |
+
"{": 28,
|
| 31 |
+
"}": 29,
|
| 32 |
+
"(": 30,
|
| 33 |
+
")": 31,
|
| 34 |
+
"$": 32,
|
| 35 |
+
",": 33,
|
| 36 |
+
":": 34,
|
| 37 |
+
"|": 35,
|
| 38 |
+
"-": 36,
|
| 39 |
+
".": 37,
|
| 40 |
+
"0": 38,
|
| 41 |
+
"1": 39,
|
| 42 |
+
"2": 40,
|
| 43 |
+
"3": 41,
|
| 44 |
+
"4": 42,
|
| 45 |
+
"5": 43,
|
| 46 |
+
"6": 44,
|
| 47 |
+
"7": 45,
|
| 48 |
+
"8": 46,
|
| 49 |
+
"9": 47,
|
| 50 |
+
"B": 48,
|
| 51 |
+
"O": 49,
|
| 52 |
+
">": 50,
|
| 53 |
+
"a": 51,
|
| 54 |
+
"b": 52,
|
| 55 |
+
"c": 53,
|
| 56 |
+
"d": 54,
|
| 57 |
+
"e": 55,
|
| 58 |
+
"f": 56,
|
| 59 |
+
"g": 57,
|
| 60 |
+
"h": 58,
|
| 61 |
+
"i": 59,
|
| 62 |
+
"l": 60,
|
| 63 |
+
"m": 61,
|
| 64 |
+
"n": 62,
|
| 65 |
+
"o": 63,
|
| 66 |
+
"p": 64,
|
| 67 |
+
"r": 65,
|
| 68 |
+
"s": 66,
|
| 69 |
+
"t": 67,
|
| 70 |
+
"u": 68,
|
| 71 |
+
"v": 69,
|
| 72 |
+
"x": 70,
|
| 73 |
+
"y": 71,
|
| 74 |
+
"z": 72,
|
| 75 |
+
"/": 73,
|
| 76 |
+
"*": 74,
|
| 77 |
+
"\t": 75,
|
| 78 |
+
"&": 76,
|
| 79 |
+
"_": 77
|
| 80 |
+
}
|