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A research framework for MCMC

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riemann: A research framework for MCMC

The Centre for Translational Data Science (CTDS) is a multidisciplinary centre for data science research at the University of Sydney, developing new methods in Bayesian statistics and machine learning to solve challenging problems across natural, biomedical, and social sciences with broad social impact. Sampling distributions by Markov chain Monte Carlo (MCMC) is a key technique consistently employed by CTDS across all its activities. Many problems can be adequately sampled using off-the-shelf technology, but since CTDS's research program involves the development of new data science methods as well as outcomes in different domain areas, there is no guarantee that off-the-shelf packages will provide good results.

This code base contains a library of advanced MCMC methods for sampling complex, high-dimensional posterior distributions. It focuses at the moment on Metropolis-Hastings proposals, since this encompasses a very broad class of widely used proposal types. The project was started in particular with geometric methods in mind -- those that take advantage of the local geometry of the posterior distribution, such as Riemannian manifold Monte Carlo -- which is why it carries the working name riemann. It is being designed with potentially quite complex models in mind, to be compatible with auto-differentiation, GPU-based code, adaptive proposals, and samplers to run on distributed architectures.

The code architecture

At present the code contains three base class hierarchies:

  • Sampler, a basic MCMC sampler
  • Proposal, an abstract base class for Metropolis-Hastings proposals
  • Model, an abstract base class for statistical models

Each Sampler will eventually understand how to display itself along with key performance plots, such as trace plots or posterior slices. Proposal instances include support for asymmetric proposals and for gradient-based proposals by forwarding a request for gradient information to each Model.

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