A Method for Finding Structured Sparse Solutions to Non-negative Least Squares Problems with Applications

Demixing problems in many areas such as hyperspectral imaging and differential optical absorption spectroscopy (DOAS) often require finding sparse nonnegative linear combinations of dictionary elements that match observed data. We show how aspects of these problems, such as misalignment of DOAS references and uncertainty in hyperspectral endmembers, can be modeled by expanding the dictionary with grouped elements and imposing a structured sparsity assumption that the combinations within each group should be sparse or even 1-sparse. If the dictionary is highly coherent, it is difficult to obtain good solutions using convex or greedy methods, such as non-negative least squares (NNLS) or orthogonal matching pursuit. We use penalties related to the Hoyer measure, which is the ratio of the $l_1$ and $l_2$ norms, as sparsity penalties to be added to the objective in NNLS-type models. For solving the resulting nonconvex models, we propose a scaled gradient projection algorithm that requires solving a sequence of strongly convex quadratic programs. We discuss its close connections to convex splitting methods and difference of convex programming. We also present promising numerical results for example DOAS analysis and hyperspectral demixing problems.

A convex model for non-negative matrix factorization and dimensionality reduction on physical space

A collaborative convex framework for factoring a data matrix $X$ into a non-negative product $AS$, with a sparse coefficient matrix $S$, is proposed. We restrict the columns of the dictionary matrix $A$ to coincide with certain columns of the data matrix $X$, thereby guaranteeing a physically meaningful dictionary and dimensionality reduction. We use $l_{1,\infty}$ regularization to select the dictionary from the data and show this leads to an exact convex relaxation of $l_0$ in the case of distinct noise free data. We also show how to relax the restriction-to-$X$ constraint by initializing an alternating minimization approach with the solution of the convex model, obtaining a dictionary close to but not necessarily in $X$. We focus on applications of the proposed framework to hyperspectral endmember and abundances identification and also show an application to blind source separation of NMR data.