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We introduce a machine-learning (ML) framework for high-throughput benchmarking of diverse representations of chemical systems against datasets of materials and molecules. The guiding principle underlying the benchmarking approach is to…

Machine Learning · Computer Science 2021-12-07 Carl Poelking , Felix A. Faber , Bingqing Cheng

The growing demand for data-driven decision-making has created an urgent need for data agents that can integrate structured and unstructured data for analysis. While data agents show promise for enabling users to perform complex analytics…

Databases · Computer Science 2025-09-03 Ziting Wang , Shize Zhang , Haitao Yuan , Jinwei Zhu , Shifu Li , Wei Dong , Gao Cong

Learned representations of scientific documents can serve as valuable input features for downstream tasks without further fine-tuning. However, existing benchmarks for evaluating these representations fail to capture the diversity of…

Computation and Language · Computer Science 2023-11-14 Amanpreet Singh , Mike D'Arcy , Arman Cohan , Doug Downey , Sergey Feldman

The use of deep learning models in computational biology has increased massively in recent years, and it is expected to continue with the current advances in the fields such as Natural Language Processing. These models, although able to…

Extracting key information from scientific papers has the potential to help researchers work more efficiently and accelerate the pace of scientific progress. Over the last few years, research on Scientific Information Extraction (SciIE)…

Computation and Language · Computer Science 2023-12-19 Yuhan Li , Jian Wu , Zhiwei Yu , Börje F. Karlsson , Wei Shen , Manabu Okumura , Chin-Yew Lin

Machine learning research depends on objectively interpretable, comparable, and reproducible algorithm benchmarks. We advocate the use of curated, comprehensive suites of machine learning tasks to standardize the setup, execution, and…

Benchmarking is crucial for testing and validating any system, even more so in real-time systems. Typical real-time applications adhere to well-understood abstractions: they exhibit a periodic behavior, operate on a well-defined working…

Software Engineering · Computer Science 2022-08-02 Mattia Nicolella , Shahin Roozkhosh , Denis Hoornaert , Andrea Bastoni , Renato Mancuso

Quantum computers have the potential to provide an advantage over classical computers in a number of areas. Numerous metrics to benchmark the performance of quantum computers, ranging from their individual hardware components to entire…

Split and Rephrase is a text simplification task of rewriting a complex sentence into simpler ones. As a relatively new task, it is paramount to ensure the soundness of its evaluation benchmark and metric. We find that the widely used…

Computation and Language · Computer Science 2020-12-15 Li Zhang , Huaiyu Zhu , Siddhartha Brahma , Yunyao Li

To cope with the intractability of answering Conjunctive Queries (CQs) and solving Constraint Satisfaction Problems (CSPs), several notions of hypergraph decompositions have been proposed -- giving rise to different notions of width,…

Databases · Computer Science 2018-11-21 Wolfgang Fischl , Georg Gottlob , Davide M. Longo , Reinhard Pichler

Molecular machine learning has been maturing rapidly over the last few years. Improved methods and the presence of larger datasets have enabled machine learning algorithms to make increasingly accurate predictions about molecular…

This paper presents Global Benchmark Database (GBD), a comprehensive suite of tools for provisioning and sustainably maintaining benchmark instances and their metadata. The availability of benchmark metadata is essential for many tasks in…

Databases · Computer Science 2026-01-15 Ashlin Iser , Christoph Jabs

One of the core challenges facing the medical image computing community is fast and efficient data sample labeling. Obtaining fine-grained labels for segmentation is particularly demanding since it is expensive, time-consuming, and requires…

Computer Vision and Pattern Recognition · Computer Science 2022-08-08 Michael Gröger , Vadim Borisov , Gjergji Kasneci

Evaluating competing systems in a comparable way, i.e., benchmarking them, is an undeniable pillar of the scientific method. However, system performance is often summarized via a small number of metrics. The analysis of the evaluation…

Machine Learning · Computer Science 2025-10-24 Quannian Zhang , Michael Röder , Nikit Srivastava , N'Dah Jean Kouagou , Axel-Cyrille Ngonga Ngomo

Optimizing scientific applications to take full advan-tage of modern memory subsystems is a continual challenge forapplication and compiler developers. Factors beyond working setsize affect performance. A benchmark framework that…

Performance · Computer Science 2018-12-20 Mahesh Lakshminarasimhan , Catherine Olschanowsky

The past few years have seen a surge of applying Deep Learning (DL) models for a wide array of tasks such as image classification, object detection, machine translation, etc. While DL models provide an opportunity to solve otherwise…

Machine Learning · Computer Science 2021-03-02 Cheng Li , Abdul Dakkak , Jinjun Xiong , Wen-mei Hwu

As the interplay between human-generated and synthetic data evolves, new challenges arise in scientific discovery concerning the integrity of the data and the stability of the models. In this work, we examine the role of synthetic data as…

Model quantization has emerged as an indispensable technique to accelerate deep learning inference. While researchers continue to push the frontier of quantization algorithms, existing quantization work is often unreproducible and…

Machine Learning · Computer Science 2022-01-26 Yuhang Li , Mingzhu Shen , Jian Ma , Yan Ren , Mingxin Zhao , Qi Zhang , Ruihao Gong , Fengwei Yu , Junjie Yan

Single-cell RNA-seq data allow the quantification of cell type differences across a growing set of biological contexts. However, pinpointing a small subset of genomic features explaining this variability can be ill-defined and…

Machine Learning · Statistics 2022-07-29 Nabeel Sarwar , Wilson Gregory , George A Kevrekidis , Soledad Villar , Bianca Dumitrascu

To cope with the intractability of answering Conjunctive Queries (CQs) and solving Constraint Satisfaction Problems (CSPs), several notions of hypergraph decompositions have been proposed -- giving rise to different notions of width,…

Databases · Computer Science 2020-09-04 Wolfgang Fischl , Georg Gottlob , Davide Mario Longo , Reinhard Pichler