In essence, people who interact with advanced technology want to be able to trust it appropriately, and then act on that trust. In interpersonal relationships, and otherwise, humans act largely based on trust. For example, a supervisor asks a subordinate to accomplish a task based on several factors that indicate they can trust them to accomplish that task. When consumers make purchases, they do so with trust that the product will perform as promised. Likewise, when using something like an autonomous vehicle, the user must be able to trust it appropriately in order to use it properly. With the rapid advancement of the capabilities of intelligent computing technology to do tasks that were previously assumed to be too complicated for computers, there has been much recent discussion regarding how humans can trust this technology - although the connection to trust is not always made explicit, per se.

In this article, we look at two machine learning (ML) techniques, Naive Bayes classifier and neural networks, and demystify how they work. With all the hype surrounding self-driving cars and video-game-playing AI robots, it's worth taking a step back and reminding ourselves how machine learning programs actually "learn". In this article, we look at two machine learning (ML) techniques–spam filters and neural networks–and demystify how they work. And if you're not sure what machine learning even is, read about the difference between artificial intelligence, machine learning, and deep learning. One common machine learning algorithm is the Naive Bayes classifier, which is used for filtering spam emails.

Preprocessing data is an important step before any data analysis. In this paper, we focus on one particular aspect, namely scaling or normalization. We analyze various scaling methods in common use and study their effects on different statistical learning models. We will propose a new two-stage scaling method. First, we use some training data to fit linear regression model and then scale the whole data based on the coefficients of regression. Simulations are conducted to illustrate the advantages of our new scaling method. Some real data analysis will also be given.

Nonnegative matrix factorization (NMF) has been actively investigated and used in a wide range of problems in the past decade. A significant amount of attention has been given to develop NMF algorithms that are suitable to model time series with strong temporal dependencies. In this paper, we propose a novel state-space approach to perform dynamic NMF (D-NMF). In the proposed probabilistic framework, the NMF coefficients act as the state variables and their dynamics are modeled using a multi-lag nonnegative vector autoregressive (N-VAR) model within the process equation. We use expectation maximization and propose a maximum-likelihood estimation framework to estimate the basis matrix and the N-VAR model parameters. Interestingly, the N-VAR model parameters are obtained by simply applying NMF. Moreover, we derive a maximum a posteriori estimate of the state variables (i.e., the NMF coefficients) that is based on a prediction step and an update step, similarly to the Kalman filter. We illustrate the benefits of the proposed approach using different numerical simulations where D-NMF significantly outperforms its static counterpart. Experimental results for three different applications show that the proposed approach outperforms two state-of-the-art NMF approaches that exploit temporal dependencies, namely a nonnegative hidden Markov model and a frame stacking approach, while it requires less memory and computational power.

The asymptotic behavior of the stochastic gradient algorithm with a biased gradient estimator is analyzed. Relying on arguments based on the dynamic system theory (chain-recurrence) and the differential geometry (Yomdin theorem and Lojasiewicz inequality), tight bounds on the asymptotic bias of the iterates generated by such an algorithm are derived. The obtained results hold under mild conditions and cover a broad class of high-dimensional nonlinear algorithms. Using these results, the asymptotic properties of the policy-gradient (reinforcement) learning and adaptive population Monte Carlo sampling are studied. Relying on the same results, the asymptotic behavior of the recursive maximum split-likelihood estimation in hidden Markov models is analyzed, too.

Markov chains and diffusion processes are indispensable tools in machine learning and statistics that are used for inference, sampling, and modeling. With the growth of large-scale datasets, the computational cost associated with simulating these stochastic processes can be considerable, and many algorithms have been proposed to approximate the underlying Markov chain or diffusion. A fundamental question is how the computational savings trade off against the statistical error incurred due to approximations. This paper develops general results that address this question. We bound the Wasserstein distance between the equilibrium distributions of two diffusions as a function of their mixing rates and the deviation in their drifts. We show that this error bound is tight in simple Gaussian settings. Our general result on continuous diffusions can be discretized to provide insights into the computational-statistical trade-off of Markov chains. As an illustration, we apply our framework to derive finite-sample error bounds of approximate unadjusted Langevin dynamics. We characterize computation-constrained settings where, by using fast-to-compute approximate gradients in the Langevin dynamics, we obtain more accurate samples compared to using the exact gradients. Finally, as an additional application of our approach, we quantify the accuracy of approximate zig-zag sampling. Our theoretical analyses are supported by simulation experiments.

A latent space model for a family of random graphs assigns real-valued vectors to nodes of the graph such that edge probabilities are determined by latent positions. Latent space models provide a natural statistical framework for graph visualizing and clustering. A latent space model of particular interest is the Random Dot Product Graph (RDPG), which can be fit using an efficient spectral method; however, this method is based on a heuristic that can fail, even in simple cases. Here, we consider a closely related latent space model, the Logistic RDPG, which uses a logistic link function to map from latent positions to edge likelihoods. Over this model, we show that asymptotically exact maximum likelihood inference of latent position vectors can be achieved using an efficient spectral method. Our method involves computing top eigenvectors of a normalized adjacency matrix and scaling eigenvectors using a regression step. The novel regression scaling step is an essential part of the proposed method. In simulations, we show that our proposed method is more accurate and more robust than common practices. We also show the effectiveness of our approach over standard real networks of the karate club and political blogs.

Towards making systems forget with machine unlearning.

We study the problem of self-interested planning under uncertainty in settings shared with more than a thousand other agents, each of which plans at its own individual level. We refer to such large numbers of agents as an agent population. The decision-theoretic formalism of interactive partially observable Markov decision process (I-POMDP) is used to model the agent's self-interested planning. The first contribution of this article is a method for drastically scaling the finitely-nested I-POMDP to certain agent populations for the first time. Our method exploits two types of structure that is often exhibited by agent populations -- anonymity and context-specific independence. We present a variant called the many-agent I-POMDP that models both these types of structure to plan efficiently under uncertainty in multiagent settings. In particular, the complexity of the belief update and solution in the many-agent I-POMDP is polynomial in the number of agents compared with the exponential growth that challenges the original framework. While exploiting structure helps mitigate the curse of many agents, the well-known curse of history that afflicts I-POMDPs continues to challenge scalability in terms of the planning horizon. The second contribution of this article is an application of the branch-and-bound scheme to reduce the exponential growth of the search tree for look ahead. For this, we introduce new fast-computing upper and lower bounds for the exact value function of the many-agent I-POMDP. This speeds up the look-ahead computations without trading off optimality, and reduces both memory and run time complexity. The third contribution is a comprehensive empirical evaluation of the methods on three new problems domains -- policing large protests, controlling traffic congestion at a busy intersection, and improving the AI for the popular Clash of Clans multiplayer game. We demonstrate the feasibility of exact self-interested planning in these large problems, and that our methods for speeding up the planning are effective. Altogether, these contributions represent a principled and significant advance toward moving self-interested planning under uncertainty to real-world applications.

This work introduces a method to tune a sequence-based generative model for molecular de novo design that through augmented episodic likelihood can learn to generate structures with certain specified desirable properties. We demonstrate how this model can execute a range of tasks such as generating analogues to a query structure and generating compounds predicted to be active against a biological target. As a proof of principle, the model is first trained to generate molecules that do not contain sulphur. As a second example, the model is trained to generate analogues to the drug Celecoxib, a technique that could be used for scaffold hopping or library expansion starting from a single molecule. Finally, when tuning the model towards generating compounds predicted to be active against the dopamine receptor type 2, the model generates structures of which more than 95% are predicted to be active, including experimentally confirmed actives that have not been included in either the generative model nor the activity prediction model.