Explainable uncertainty quantifications for deep learning-based molecular property prediction
CI Yang, YP Li - Journal of Cheminformatics, 2023 - Springer
Quantifying uncertainty in machine learning is important in new research areas with scarce
high-quality data. In this work, we develop an explainable uncertainty quantification method …
high-quality data. In this work, we develop an explainable uncertainty quantification method …
Conformal prediction with missing values
Conformal prediction is a theoretically grounded framework for constructing predictive
intervals. We study conformal prediction with missing values in the covariates–a setting that …
intervals. We study conformal prediction with missing values in the covariates–a setting that …
Improving uncertainty quantification of deep classifiers via neighborhood conformal prediction: Novel algorithm and theoretical analysis
Safe deployment of deep neural networks in high-stake real-world applications require
theoretically sound uncertainty quantification. Conformal prediction (CP) is a principled …
theoretically sound uncertainty quantification. Conformal prediction (CP) is a principled …
Few-shot calibration of set predictors via meta-learned cross-validation-based conformal prediction
Conventional frequentist learning is known to yield poorly calibrated models that fail to
reliably quantify the uncertainty of their decisions. Bayesian learning can improve …
reliably quantify the uncertainty of their decisions. Bayesian learning can improve …
Conformal prediction with temporal quantile adjustments
Abstract We develop Temporal Quantile Adjustment (TQA), a general method to construct
efficient and valid prediction intervals (PIs) for regression on cross-sectional time series …
efficient and valid prediction intervals (PIs) for regression on cross-sectional time series …
Adaptive conformal prediction by reweighting nonconformity score
SI Amoukou, NJB Brunel - arXiv preprint arXiv:2303.12695, 2023 - arxiv.org
Despite attractive theoretical guarantees and practical successes, Predictive Interval (PI)
given by Conformal Prediction (CP) may not reflect the uncertainty of a given model. This …
given by Conformal Prediction (CP) may not reflect the uncertainty of a given model. This …
Approximating full conformal prediction at scale via influence functions
Conformal prediction (CP) is a wrapper around traditional machine learning models, giving
coverage guarantees under the sole assumption of exchangeability; in classification …
coverage guarantees under the sole assumption of exchangeability; in classification …
Conformal prediction intervals with temporal dependence
Cross-sectional prediction is common in many domains such as healthcare, including
forecasting tasks using electronic health records, where different patients form a cross …
forecasting tasks using electronic health records, where different patients form a cross …
Adaptive conformal regression with jackknife+ rescaled scores
Conformal regression provides prediction intervals with global coverage guarantees, but
often fails to capture local error distributions, leading to non-homogeneous coverage. We …
often fails to capture local error distributions, leading to non-homogeneous coverage. We …
MetaSTNet: Multimodal Meta-learning for Cellular Traffic Conformal Prediction
Network traffic prediction techniques have attracted much attention since they are valuable
for network congestion control and user experience improvement. While existing prediction …
for network congestion control and user experience improvement. While existing prediction …