dmlc--dgl
Hongzhi (Steve), Chen
23d09057e3
* [Misc] Black auto fix. * sort Co-authored-by: Steve <ubuntu@ip-172-31-34-29.ap-northeast-1.compute.internal>
24 行
610 B
Python
24 行
610 B
Python
import torch.nn as nn
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class Envelope(nn.Module):
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"""
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Envelope function that ensures a smooth cutoff
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"""
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def __init__(self, exponent):
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super(Envelope, self).__init__()
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self.p = exponent + 1
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self.a = -(self.p + 1) * (self.p + 2) / 2
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self.b = self.p * (self.p + 2)
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self.c = -self.p * (self.p + 1) / 2
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def forward(self, x):
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# Envelope function divided by r
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x_p_0 = x.pow(self.p - 1)
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x_p_1 = x_p_0 * x
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x_p_2 = x_p_1 * x
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env_val = 1 / x + self.a * x_p_0 + self.b * x_p_1 + self.c * x_p_2
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return env_val
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