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Information Geometry: The Mathematics

Information geometry studies families of probability distributions as differentiable manifolds equipped with a Riemannian metric and a pair of affine connections. The exposition below states the standard definitions and the principal structural results, following the framework of Čencov and Amari.

Statistical manifolds

Let $\mathcal{X}$ be a sample space. A statistical model is a family

$$ \mathcal{S} = {, p_\theta : \theta = (\theta^1, \dots, \theta^n) \in \Theta \subseteq \mathbb{R}^n ,} $$

of probability distributions $p_\theta(x)$ on $\mathcal{X}$, smoothly parametrized by $\theta$. Under regularity conditions — the map $\theta \mapsto p_\theta$ is injective and smooth, the support does not depend on $\theta$, and the score functions are linearly independent — the model is a statistical manifold: $\Theta$ supplies a coordinate chart, and $n$ is its dimension.

Two standard examples. The family of univariate Gaussians $N(\mu, \sigma^2)$ is a $2$-dimensional manifold with coordinates $(\mu, \sigma)$. The interior of the probability simplex on $k+1$ outcomes, ${(p_0, \dots, p_k) : p_i > 0,\ \sum_i p_i = 1}$, is a $k$-dimensional manifold of categorical distributions.

The Fisher information matrix as a Riemannian metric

Write $\ell_\theta(x) = \log p_\theta(x)$. The score is the gradient $\partial_i \ell_\theta = \partial \ell_\theta / \partial \theta^i$, which has mean zero: $\mathbb{E}\theta[\partial_i \ell\theta] = 0$. The Fisher information matrix is the covariance of the score,

$$ g_{ij}(\theta) = \mathbb{E}\theta!\big[, \partial_i \ell\theta , \partial_j \ell_\theta ,\big] = -,\mathbb{E}\theta!\big[, \partial_i \partial_j \ell\theta ,\big], $$

the second equality holding under the regularity that permits differentiating under the integral sign. The matrix $g(\theta) = (g_{ij}(\theta))$ is symmetric and positive semidefinite; under the linear-independence assumption above it is positive definite, hence defines an inner product on each tangent space $T_\theta \mathcal{S}$. Assembled smoothly over $\Theta$, this is the Fisher–Rao metric, a Riemannian metric on $\mathcal{S}$.

The Fisher metric transforms correctly as a $(0,2)$-tensor under reparametrization $\theta \mapsto \xi$, so the geometry it defines is independent of the chosen coordinates. Čencov's theorem characterizes it: on the manifolds of categorical distributions, the Fisher information metric is the unique Riemannian metric (up to a positive scalar) that is invariant under sufficient statistics (Markov morphisms). This monotonicity/invariance property is the precise sense in which the metric is canonical.

Kullback–Leibler divergence — and why it is not a metric

For $p, q$ on $\mathcal{X}$, the Kullback–Leibler divergence is

$$ D_{\mathrm{KL}}(p ,|, q) = \mathbb{E}_p!\left[ \log \frac{p(x)}{q(x)} \right] = \sum_x p(x) \log \frac{p(x)}{q(x)} \quad (\text{integral in the continuous case}). $$

By Gibbs' inequality $D_{\mathrm{KL}}(p ,|, q) \ge 0$, with equality if and only if $p = q$ almost everywhere. So it separates points and is sometimes read as a "distance," but it is a divergence, not a metric, for two reasons:

  1. Asymmetry. In general $D_{\mathrm{KL}}(p ,|, q) \neq D_{\mathrm{KL}}(q ,|, p)$.
  2. No triangle inequality. There is no general bound of the form $D_{\mathrm{KL}}(p ,|, r) \le D_{\mathrm{KL}}(p ,|, q) + D_{\mathrm{KL}}(q ,|, r)$.

The connection to the metric is infinitesimal. For nearby parameters, the second-order Taylor expansion is

$$ D_{\mathrm{KL}}(p_\theta ,|, p_{\theta + d\theta}) = \tfrac{1}{2}, g_{ij}(\theta), d\theta^i, d\theta^j + O(|d\theta|^3), $$

so the Fisher metric is exactly the leading-order quadratic form of the KL divergence. The first-order term vanishes because $\theta$ is a stationary point of $\theta' \mapsto D_{\mathrm{KL}}(p_\theta ,|, p_{\theta'})$.

Dual affine connections and the $\alpha$-connections

A statistical manifold carries more structure than the metric alone: a one-parameter family of torsion-free affine connections. For $\alpha \in \mathbb{R}$, Amari's $\alpha$-connection $\nabla^{(\alpha)}$ has Christoffel symbols (in the form $\Gamma_{ij,k}$) given by

$$ \Gamma^{(\alpha)}{ij,k}(\theta) = \mathbb{E}\theta!\left[\left( \partial_i \partial_j \ell_\theta + \frac{1-\alpha}{2}, \partial_i \ell_\theta, \partial_j \ell_\theta \right) \partial_k \ell_\theta \right]. $$

Special cases: $\nabla^{(0)}$ is the Levi-Civita connection of the Fisher metric; $\nabla^{(1)} =: \nabla^{(e)}$ is the exponential connection; $\nabla^{(-1)} =: \nabla^{(m)}$ is the mixture connection.

The connections $\nabla^{(\alpha)}$ and $\nabla^{(-\alpha)}$ are dual with respect to the Fisher metric $g$: for vector fields $X, Y, Z$,

$$ X, g(Y, Z) = g!\left( \nabla^{(\alpha)}_X Y,, Z \right) + g!\left( Y,, \nabla^{(-\alpha)}_X Z \right). $$

Equivalently $\tfrac{1}{2}(\nabla^{(\alpha)} + \nabla^{(-\alpha)}) = \nabla^{(0)}$. The triple $(g, \nabla^{(\alpha)}, \nabla^{(-\alpha)})$ is a dualistic structure.

A manifold is dually flat when both $\nabla^{(e)}$ and $\nabla^{(m)}$ are flat (zero curvature and torsion). Exponential families are dually flat: the natural parameters are $\nabla^{(e)}$-affine coordinates, the expectation parameters are $\nabla^{(m)}$-affine coordinates, and the two systems are related by a Legendre transform of the log-partition function. On a dually flat manifold the canonical divergence is a Bregman divergence and reduces to the KL divergence for exponential families.

Geodesics

Each connection has its own geodesics — curves $\gamma(t)$ with $\nabla_{\dot\gamma} \dot\gamma = 0$. The $\nabla^{(0)}$-geodesics minimize Fisher–Rao arc length. The e-geodesics ($\nabla^{(e)}$) are straight lines in the natural parameters; the m-geodesics ($\nabla^{(m)}$) are straight lines in the expectation parameters, i.e. $t \mapsto (1-t),p_0 + t,p_1$ in distribution space. These coincide only when $\alpha = 0$, i.e. for the metric connection.

On dually flat manifolds the generalized Pythagorean theorem holds: if the m-geodesic from $p$ to $q$ is orthogonal (in the Fisher metric) to the e-geodesic from $q$ to $r$, then

$$ D(p ,|, r) = D(p ,|, q) + D(q ,|, r), $$

with $D$ the canonical divergence. This underlies the projection theorem: the divergence-minimizing point of a distribution onto a flat submanifold is unique and is obtained by orthogonal geodesic projection.

The natural gradient

Let $L(\theta)$ be a smooth objective on a statistical manifold with metric $g$. The ordinary gradient $\nabla L = (\partial_i L)$ depends on the coordinates and is not the direction of steepest ascent with respect to $g$. The natural gradient is

$$ \tilde\nabla L(\theta) = g(\theta)^{-1}, \nabla L(\theta), $$

the Riemannian gradient: the steepest-ascent direction under the Fisher metric, with the steepest-descent update $\theta_{t+1} = \theta_t - \eta, g(\theta_t)^{-1} \nabla L(\theta_t)$. Because $g$ transforms as a $(0,2)$-tensor and $\nabla L$ as a $(0,1)$-tensor, the product $g^{-1}\nabla L$ is a vector and the update is invariant to smooth reparametrization. Amari (1998) introduced natural gradient descent on this basis; its cost is the formation and inversion of $g(\theta)$, which is $O(n^3)$ per step in general and the practical obstacle that motivates approximations (block-diagonal, Kronecker-factored, and empirical-Fisher schemes).

Sources

  • S. Amari and H. Nagaoka, Methods of Information Geometry, AMS/OUP, 2000.
  • S. Amari, "Natural Gradient Works Efficiently in Learning," Neural Computation 10(2), 1998.
  • F. Nielsen, "An Elementary Introduction to Information Geometry," Entropy 22(10), 2020. arXiv:1808.08271.