def _mmd2(K_XX, K_XY, K_YY, const_diagonal=False, biased=False):
m = K_XX.size(0) # assume X, Y are same shape
# Get the various sums of kernels that we'll use
# Kts drop the diagonal, but we don't need to compute them explicitly
if const_diagonal is not False:
diag_X = diag_Y = const_diagonal
sum_diag_X = sum_diag_Y = m * const_diagonal
else:
diag_X = torch.diag(K_XX) # (m,)
diag_Y = torch.diag(K_YY) # (m,)
sum_diag_X = torch.sum(diag_X)
sum_diag_Y = torch.sum(diag_Y)
Kt_XX_sums = K_XX.sum(dim=1) - diag_X # \tilde{K}_XX * e = K_XX * e - diag_X
Kt_YY_sums = K_YY.sum(dim=1) - diag_Y # \tilde{K}_YY * e = K_YY * e - diag_Y
K_XY_sums_0 = K_XY.sum(dim=0) # K_{XY}^T * e
Kt_XX_sum = Kt_XX_sums.sum() # e^T * \tilde{K}_XX * e
Kt_YY_sum = Kt_YY_sums.sum() # e^T * \tilde{K}_YY * e
K_XY_sum = K_XY_sums_0.sum() # e^T * K_{XY} * e
if biased:
mmd2 = ((Kt_XX_sum + sum_diag_X) / (m * m)
+ (Kt_YY_sum + sum_diag_Y) / (m * m)
- 2.0 * K_XY_sum / (m * m))
else:
mmd2 = (Kt_XX_sum / (m * (m - 1))
+ Kt_YY_sum / (m * (m - 1))
- 2.0 * K_XY_sum / (m * m))
return mmd2
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