Covariate shift in the test data is a common practical phenomena that can significantly downgrade both the accuracy and the fairness performance of the model. Ensuring fairness across different sensitive groups under covariate shift is of paramount importance due to societal implications like criminal justice. We operate in the unsupervised regime where only a small set of unlabeled test samples along with a labeled training set is available. Towards improving fairness under this highly challenging yet realistic scenario, we make three contributions. First is a novel composite weighted entropy based objective for prediction accuracy which is optimized along with a representation matching loss for fairness. We experimentally verify that optimizing with our loss formulation outperforms a number of state-of-the-art baselines in the pareto sense with respect to the fairness-accuracy tradeoff on several standard datasets. Our second contribution is a new setting we term Asymmetric Covariate Shift that, to the best of our knowledge, has not been studied before. Asymmetric covariate shift occurs when distribution of covariates of one group shifts significantly compared to the other groups and this happens when a dominant group is over-represented. While this setting is extremely challenging for current baselines, We show that our proposed method significantly outperforms them. Our third contribution is theoretical, where we show that our weighted entropy term along with prediction loss on the training set approximates test loss under covariate shift. Empirically and through formal sample complexity bounds, we show that this approximation to the unseen test loss does not depend on importance sampling variance which affects many other baselines.

Machine learning tasks over image databases often generate masks that annotate image content (e.g., saliency maps, segmentation maps, depth maps) and enable a variety of applications (e.g., determine if a model is learning spurious correlations or if an image was maliciously modified to mislead a model). While queries that retrieve examples based on mask properties are valuable to practitioners, existing systems do not support them efficiently. In this paper, we formalize the problem and propose MaskSearch, a system that focuses on accelerating queries over databases of image masks while guaranteeing the correctness of query results. MaskSearch leverages a novel indexing technique and an efficient filter-verification query execution framework. Experiments with our prototype show that MaskSearch, using indexes approximately 5% of the compressed data size, accelerates individual queries by up to two orders of magnitude and consistently outperforms existing methods on various multi-query workloads that simulate dataset exploration and analysis processes.

We present a system for anomaly detection in histopathological images. In histology, normal samples are usually abundant, whereas anomalous (pathological) cases are scarce or not available. Under such settings, one-class classifiers trained on healthy data can detect out-of-distribution anomalous samples. Such approaches combined with pre-trained Convolutional Neural Network (CNN) representations of images were previously employed for anomaly detection (AD). However, pre-trained off-the-shelf CNN representations may not be sensitive to abnormal conditions in tissues, while natural variations of healthy tissue may result in distant representations. To adapt representations to relevant details in healthy tissue we propose training a CNN on an auxiliary task that discriminates healthy tissue of different species, organs, and staining reagents. Almost no additional labeling workload is required, since healthy samples come automatically with aforementioned labels. During training we enforce compact image representations with a center-loss term, which further improves representations for AD. The proposed system outperforms established AD methods on a published dataset of liver anomalies. Moreover, it provided comparable results to conventional methods specifically tailored for quantification of liver anomalies. We show that our approach can be used for toxicity assessment of candidate drugs at early development stages and thereby may reduce expensive late-stage drug attrition.

Graph Neural Networks (GNNs) are able to achieve high classification accuracy on many important real world datasets, but provide no rigorous notion of predictive uncertainty. Quantifying the confidence of GNN models is difficult due to the dependence between datapoints induced by the graph structure. We leverage recent advances in conformal prediction to construct prediction sets for node classification in inductive learning scenarios. We do this by taking an existing approach for conformal classification that relies on \textit{exchangeable} data and modifying it by appropriately weighting the conformal scores to reflect the network structure. We show through experiments on standard benchmark datasets using popular GNN models that our approach provides tighter and better calibrated prediction sets than a naive application of conformal prediction.

This study proposes a Newton based multiple-objective optimization algorithm for hyperparameter search. The first order differential (gradient) is calculated using finite difference method and a gradient matrix with vectorization is formed for fast computation. The Newton Raphson iterative solution is used to update model parameters with iterations, and a regularization term is included to eliminate the singularity issue. The algorithm is applied to search the optimal probability threshold (a vector of eight parameters) for a multi-class object detection problem of a convolutional neural network. The algorithm quickly finds the improved parameter values to produce an overall higher true positive (TP) and lower false positive (FP) rates, as compared to using the default value of 0.5. In comparison, the Bayesian optimization generates lower performance in the testing case. However, the performance and parameter values may "oscillate" for some cases during iterations, which may be due to the data-driven stochastic nature of the subject. Therefore, the optimal parameter value can be identified from a list of iteration steps according to the optimal TP and FP results.

Federated learning (FL) has emerged as a prospective solution for collaboratively learning a shared model across clients without sacrificing their data privacy. However, the federated learned model tends to be biased against certain demographic groups (e.g., racial and gender groups) due to the inherent FL properties, such as data heterogeneity and party selection. Unlike centralized learning, mitigating bias in FL is particularly challenging as private training datasets and their sensitive attributes are typically not directly accessible. Most prior research in this field only focuses on global fairness while overlooking the local fairness of individual clients. Moreover, existing methods often require sensitive information about the client's local datasets to be shared, which is not desirable. To address these issues, we propose GLOCALFAIR, a client-server co-design fairness framework that can jointly improve global and local group fairness in FL without the need for sensitive statistics about the client's private datasets. Specifically, we utilize constrained optimization to enforce local fairness on the client side and adopt a fairness-aware clustering-based aggregation on the server to further ensure the global model fairness across different sensitive groups while maintaining high utility. Experiments on two image datasets and one tabular dataset with various state-of-the-art fairness baselines show that GLOCALFAIR can achieve enhanced fairness under both global and local data distributions while maintaining a good level of utility and client fairness.

As the use of Blockchain for digital payments continues to rise in popularity, it also becomes susceptible to various malicious attacks. Successfully detecting anomalies within Blockchain transactions is essential for bolstering trust in digital payments. However, the task of anomaly detection in Blockchain transaction data is challenging due to the infrequent occurrence of illicit transactions. Although several studies have been conducted in the field, a limitation persists: the lack of explanations for the model's predictions. This study seeks to overcome this limitation by integrating eXplainable Artificial Intelligence (XAI) techniques and anomaly rules into tree-based ensemble classifiers for detecting anomalous Bitcoin transactions. The Shapley Additive exPlanation (SHAP) method is employed to measure the contribution of each feature, and it is compatible with ensemble models. Moreover, we present rules for interpreting whether a Bitcoin transaction is anomalous or not. Additionally, we have introduced an under-sampling algorithm named XGBCLUS, designed to balance anomalous and non-anomalous transaction data. This algorithm is compared against other commonly used under-sampling and over-sampling techniques. Finally, the outcomes of various tree-based single classifiers are compared with those of stacking and voting ensemble classifiers. Our experimental results demonstrate that: (i) XGBCLUS enhances TPR and ROC-AUC scores compared to state-of-the-art under-sampling and over-sampling techniques, and (ii) our proposed ensemble classifiers outperform traditional single tree-based machine learning classifiers in terms of accuracy, TPR, and FPR scores.

Despite a sea of interpretability methods that can produce plausible explanations, the field has also empirically seen many failure cases of such methods. In light of these results, it remains unclear for practitioners how to use these methods and choose between them in a principled way. In this paper, we show that for moderately rich model classes (easily satisfied by neural networks), any feature attribution method that is complete and linear -- for example, Integrated Gradients and SHAP -- can provably fail to improve on random guessing for inferring model behaviour. Our results apply to common end-tasks such as characterizing local model behaviour, identifying spurious features, and algorithmic recourse. One takeaway from our work is the importance of concretely defining end-tasks: once such an end-task is defined, a simple and direct approach of repeated model evaluations can outperform many other complex feature attribution methods.

The importance of uncertainty quantification is increasingly recognized in the diverse field of machine learning. Accurately assessing model prediction uncertainty can help provide deeper understanding and confidence for researchers and practitioners. This is especially critical in medical diagnosis and drug discovery areas, where reliable predictions directly impact research quality and patient health. In this paper, we proposed incorporating uncertainty quantification into clinical trial outcome predictions. Our main goal is to enhance the model's ability to discern nuanced differences, thereby significantly improving its overall performance. We have adopted a selective classification approach to fulfill our objective, integrating it seamlessly with the Hierarchical Interaction Network (HINT), which is at the forefront of clinical trial prediction modeling. Selective classification, encompassing a spectrum of methods for uncertainty quantification, empowers the model to withhold decision-making in the face of samples marked by ambiguity or low confidence, thereby amplifying the accuracy of predictions for the instances it chooses to classify. A series of comprehensive experiments demonstrate that incorporating selective classification into clinical trial predictions markedly enhances the model's performance, as evidenced by significant upticks in pivotal metrics such as PR-AUC, F1, ROC-AUC, and overall accuracy. Specifically, the proposed method achieved 32.37\%, 21.43\%, and 13.27\% relative improvement on PR-AUC over the base model (HINT) in phase I, II, and III trial outcome prediction, respectively. When predicting phase III, our method reaches 0.9022 PR-AUC scores. These findings illustrate the robustness and prospective utility of this strategy within the area of clinical trial predictions, potentially setting a new benchmark in the field.

This research introduces a sophisticated transfer learning model based on Google's MobileNetV2 for breast cancer tumor classification into normal, benign, and malignant categories, utilizing a dataset of 1576 ultrasound images (265 normal, 891 benign, 420 malignant). The model achieves an accuracy of 0.82, precision of 0.83, recall of 0.81, ROC-AUC of 0.94, PR-AUC of 0.88, and MCC of 0.74. It examines image intensity distributions and misclassification errors, offering improvements for future applications. Addressing dataset imbalances, the study ensures a generalizable model. This work, using a dataset from Baheya Hospital, Cairo, Egypt, compiled by Walid Al-Dhabyani et al., emphasizes MobileNetV2's potential in medical imaging, aiming to improve diagnostic precision in oncology. Additionally, the paper explores Streamlit-based deployment for real-time tumor classification, demonstrating MobileNetV2's applicability in medical imaging and setting a benchmark for future research in oncology diagnostics.