Staying the course: Locating equilibria of dynamical systems on Riemannian manifolds defined by point-clouds
share
We introduce a method to successively locate equilibria (steady states) of dynamical systems on Riemannian manifolds. The manifolds need not be characterized by an atlas or by the zeros of a smooth map. Instead, they can be defined by point-clouds and sampled as needed through an iterative process. If the manifold is an Euclidean space, our method follows isoclines, curves along which the direction of the vector field X is constant. For a generic vector field X, isoclines are smooth curves and every equilibrium is a limit point of isoclines. We generalize the definition of isoclines to Riemannian manifolds through the use of parallel transport: generalized isoclines are curves along which the directions of X are parallel transports of each other. As in the Euclidean case, generalized isoclines of generic vector fields X are smooth curves that connect equilibria of X. Our work is motivated by computational statistical mechanics, specifically high dimensional (stochastic) differential equations that model the dynamics of molecular systems. Often, these dynamics concentrate near low-dimensional manifolds and have transitions (sadddle points with a single unstable direction) between metastable equilibria We employ iteratively sampled data and isoclines to locate these saddle points. Coupling a black-box sampling scheme (e.g., Markov chain Monte Carlo) with manifold learning techniques (diffusion maps in the case presented here), we show that our method reliably locates equilibria of X.
READ FULL TEXT
