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Deep learning architectures have proved versatile in a number of drug discovery applications, including the modelling of in vitro compound activity. While controlling for prediction confidence is essential to increase the trust,…

Machine Learning · Computer Science 2018-10-23 Isidro Cortes-Ciriano , Andreas Bender

Probabilistic modeling is cyclical: we specify a model, infer its posterior, and evaluate its performance. Evaluation drives the cycle, as we revise our model based on how it performs. This requires a metric. Traditionally, predictive…

Machine Learning · Statistics 2016-05-25 Alp Kucukelbir , David M. Blei

The concepts of faithfulness and strong-faithfulness are important for statistical learning of graphical models. Graphs are not sufficient for describing the association structure of a discrete distribution. Hypergraphs representing…

Methodology · Statistics 2015-01-26 Anna Klimova , Caroline Uhler , Tamas Rudas

Corrected confidence intervals are developed for the mean of the second component of a bivariate normal process when the first component is being monitored sequentially. This is accomplished by constructing a first approximation to a…

Statistics Theory · Mathematics 2007-06-13 R. C. Weng , D. S. Coad

Consider a finite sample from an unknown distribution over a countable alphabet. Unobserved events are alphabet symbols which do not appear in the sample. Estimating the probabilities of unobserved events is a basic problem in statistics…

Statistics Theory · Mathematics 2022-11-08 Amichai Painsky

Conformal prediction is a distribution-free technique for establishing valid prediction intervals. Although conventionally people conduct conformal prediction in the output space, this is not the only possibility. In this paper, we propose…

Machine Learning · Computer Science 2023-04-11 Jiaye Teng , Chuan Wen , Dinghuai Zhang , Yoshua Bengio , Yang Gao , Yang Yuan

Matching algorithms are commonly used to predict matches between items in a collection. For example, in 1:1 face verification, a matching algorithm predicts whether two face images depict the same person. Accurately assessing the…

Methodology · Statistics 2024-04-30 Riccardo Fogliato , Pratik Patil , Pietro Perona

In many statistical problems, several estimators are usually available for interval estimation of a parameter of interest, and hence, the selection of an appropriate estimator is important. The criterion for a good estimator is to have a…

Methodology · Statistics 2018-10-10 Richard Minkah , Tertius de Wet

In recent years the ultrahigh dimensional linear regression problem has attracted enormous attentions from the research community. Under the sparsity assumption most of the published work is devoted to the selection and estimation of the…

Methodology · Statistics 2013-05-01 Randy C. S. Lai , Jan Hannig , Thomas C. M. Lee

When we use simulation to evaluate the performance of a stochastic system, the simulation often contains input distributions estimated from real-world data; therefore, there is both simulation and input uncertainty in the performance…

Methodology · Statistics 2020-11-10 Wei Xie , Barry L. Nelson , Russell R. Barton

Meaningful uncertainty quantification in computer vision requires reasoning about semantic information -- say, the hair color of the person in a photo or the location of a car on the street. To this end, recent breakthroughs in generative…

Computer Vision and Pattern Recognition · Computer Science 2022-12-02 Swami Sankaranarayanan , Anastasios N. Angelopoulos , Stephen Bates , Yaniv Romano , Phillip Isola

Point estimation of class prevalences in the presence of data set shift has been a popular research topic for more than two decades. Less attention has been paid to the construction of confidence and prediction intervals for estimates of…

Machine Learning · Statistics 2019-07-23 Dirk Tasche

As machine learning models are increasingly deployed in dynamic environments, it becomes paramount to assess and quantify uncertainties associated with distribution shifts. A distribution shift occurs when the underlying data-generating…

Methodology · Statistics 2024-10-08 Jiawei Ge , Debarghya Mukherjee , Jianqing Fan

Motivated by the questions of risk assessment in climatology (temperature change in North America) and medicine (impact of statin usage and COVID-19 on hospitalized patients), we address the problem of estimating the set in the domain of a…

Methodology · Statistics 2025-04-29 Junting Ren , Fabian J. E. Telschow , Armin Schwartzman

Conventional methods in causal effect inferencetypically rely on specifying a valid set of control variables. When this set is unknown or misspecified, inferences will be erroneous. We propose a method for inferring average causal effects…

Methodology · Statistics 2021-06-14 Ludvig Hult , Dave Zachariah

Post-selection inference consists in providing statistical guarantees, based on a data set, that are robust to a prior model selection step on the same data set. In this paper, we address an instance of the post-selection-inference problem,…

Statistics Theory · Mathematics 2025-06-16 Dominique Bontemps , François Bachoc , Pierre Neuvial

An important factor to guarantee a fair use of data-driven recommendation systems is that we should be able to communicate their uncertainty to decision makers. This can be accomplished by constructing prediction intervals, which provide an…

Methodology · Statistics 2019-08-16 Yaniv Romano , Rina Foygel Barber , Chiara Sabatti , Emmanuel J. Candès

Reliable confidence measures of metrics derived from medical imaging reconstruction pipelines would improve the standard of decision-making in many clinical workflows. Conformal Prediction (CP) provides a robust framework for producing…

A prediction interval covers a future observation from a random process in repeated sampling, and is typically constructed by identifying a pivotal quantity that is also an ancillary statistic. Analogously, a tolerance interval covers a…

Methodology · Statistics 2022-01-19 Geoffrey S Johnson

In data analysis problems where we are not able to rely on distributional assumptions, what types of inference guarantees can still be obtained? Many popular methods, such as holdout methods, cross-validation methods, and conformal…

Statistics Theory · Mathematics 2022-05-31 Yonghoon Lee , Rina Foygel Barber