concave
Saddle Networks: Structure-Preserving Architectures for Convex-Concave Functions
Saddle-point models arise throughout optimization, optimal transport, robust learning, and control. In many applications, the relevant function f(x,y) is convex in x and concave in y, and preserving this geometry is essential for obtaining tractable min--max formulations and reliable certificates. We introduce a structured separable decomposition that preserves the convex-concave geometry and prove a complete one-dimensional approximation theorem under a mixed Monge-type convexity condition. We then describe practical saddle network architectures that preserve convexity in x and concavity in y by construction. The proposed architectures require only convexity-preserving neural networks, together with simple output transformations enforcing sign and concavity constraints. Finally, we report numerical benchmarks in dimension 1 and 5, showing that the proposed saddle networks achieve high accuracy on smooth, nonsmooth, and high-rank convex--concave test functions.
Learning Concave Conditional Likelihood Models for Improved Analysis of Tandem Mass Spectra
The most widely used technology to identify the proteins present in a complex biological sample is tandem mass spectrometry, which quickly produces a large collection of spectra representative of the peptides (i.e., protein subsequences) present in the original sample. In this work, we greatly expand the parameter learning capabilities of a dynamic Bayesian network (DBN) peptide-scoring algorithm, Didea, by deriving emission distributions for which its conditional log-likelihood scoring function remains concave. We show that this class of emission distributions, called Convex Virtual Emissions (CVEs), naturally generalizes the log-sum-exp function while rendering both maximum likelihood estimation and conditional maximum likelihood estimation concave for a wide range of Bayesian networks. Utilizing CVEs in Didea allows efficient learning of a large number of parameters while ensuring global convergence, in stark contrast to Didea's previous parameter learning framework (which could only learn a single parameter using a costly grid search) and other trainable models (which only ensure convergence to local optima). The newly trained scoring function substantially outperforms the state-of-the-art in both scoring function accuracy and downstream Fisher kernel analysis. Furthermore, we significantly improve Didea's runtime performance through successive optimizations to its message passing schedule and derive explicit connections between Didea's new concave score and related MS/MS scoring functions.
Diminishing Returns Shape Constraints for Interpretability and Regularization
Maya Gupta, Dara Bahri, Andrew Cotter, Kevin Canini
Similarly, a model that predicts the time it will take a customer to grocery shop should decrease in the number of cashiers, but each addedcashierreduces average wait time by less. In both cases, we would like to be able to incorporate this prior knowledge by constraining the machine learned model's output to have a diminishing returns response to the size of the apartment or number of cashiers.