Source code for torch_geometric.nn.glob.attention

import torch
from torch_scatter import scatter_add
from torch_geometric.utils import softmax

from ..inits import reset

[docs]class GlobalAttention(torch.nn.Module): r"""Global soft attention layer from the `"Gated Graph Sequence Neural Networks" <>`_ paper .. math:: \mathbf{r}_i = \sum_{n=1}^{N_i} \mathrm{softmax} \left( h_{\mathrm{gate}} ( \mathbf{x}_n ) \right) \odot h_{\mathbf{\Theta}} ( \mathbf{x}_n ), where :math:`h_{\mathrm{gate}} \colon \mathbb{R}^F \to \mathbb{R}` and :math:`h_{\mathbf{\Theta}}` denote neural networks, *i.e.* MLPS. Args: gate_nn (torch.nn.Module): A neural network :math:`h_{\mathrm{gate}}` that computes attention scores by mapping node features :obj:`x` of shape :obj:`[-1, in_channels]` to shape :obj:`[-1, 1]`, *e.g.*, defined by :class:`torch.nn.Sequential`. nn (torch.nn.Module, optional): A neural network :math:`h_{\mathbf{\Theta}}` that maps node features :obj:`x` of shape :obj:`[-1, in_channels]` to shape :obj:`[-1, out_channels]` before combining them with the attention scores, *e.g.*, defined by :class:`torch.nn.Sequential`. (default: :obj:`None`) """ def __init__(self, gate_nn, nn=None): super(GlobalAttention, self).__init__() self.gate_nn = gate_nn self.nn = nn self.reset_parameters()
[docs] def reset_parameters(self): reset(self.gate_nn) reset(self.nn)
[docs] def forward(self, x, batch, size=None): """""" x = x.unsqueeze(-1) if x.dim() == 1 else x size = batch[-1].item() + 1 if size is None else size gate = self.gate_nn(x).view(-1, 1) x = self.nn(x) if self.nn is not None else x assert gate.dim() == x.dim() and gate.size(0) == x.size(0) gate = softmax(gate, batch, size) out = scatter_add(gate * x, batch, dim=0, dim_size=size) return out
def __repr__(self): return '{}(gate_nn={}, nn={})'.format(self.__class__.__name__, self.gate_nn, self.nn)