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Proposing new materials by atom substitution based on periodic table similarity is a conventional strategy of searching for materials with desired property. We introduce a machine learning frame work that promotes this paradigm to be…

Materials Science · Physics 2019-04-19 Lei Gu , Ruqian Wu

Approximate Bayesian computation (ABC) methods provide an elaborate approach to Bayesian inference on complex models, including model choice. Both theoretical arguments and simulation experiments indicate, however, that model posterior…

Accurate prediction of users' responses to items is one of the main aims of many computational advising applications. Examples include recommending movies, news articles, songs, jobs, clothes, books and so forth. Accurate prediction of…

Applications · Statistics 2022-12-20 Baode Gao , Guangpeng Zhan , Hanzhang Wang , Yiming Wang , Shengxin Zhu

We present Neural Random Forest Imitation - a novel approach for transforming random forests into neural networks. Existing methods propose a direct mapping and produce very inefficient architectures. In this work, we introduce an imitation…

Machine Learning · Computer Science 2024-04-05 Christoph Reinders , Bodo Rosenhahn

In theorem provers based on dependent type theory such as Coq and Lean, induction is a fundamental proof method and induction tactics are omnipresent in proof scripts. Yet the ergonomics of existing induction tactics are not ideal: they do…

Logic in Computer Science · Computer Science 2020-12-17 Jannis Limperg

Automated decision making is used routinely throughout our everyday life. Recommender systems decide which jobs, movies, or other user profiles might be interesting to us. Spell checkers help us to make good use of language. Fraud detection…

Machine Learning · Computer Science 2020-07-15 Alexander Jung , Pedro H. J. Nardelli

Large language models (LLMs) have shown promise in proving formal theorems using proof assistants such as Lean. However, existing methods are difficult to reproduce or build on, due to private code, data, and large compute requirements.…

Machine Learning · Computer Science 2023-10-30 Kaiyu Yang , Aidan M. Swope , Alex Gu , Rahul Chalamala , Peiyang Song , Shixing Yu , Saad Godil , Ryan Prenger , Anima Anandkumar

One compelling vision of the future of materials discovery and design involves the use of machine learning (ML) models to predict materials properties and then rapidly find materials tailored for specific applications. However, realizing…

Classical models for supervised machine learning, such as decision trees, are efficient and interpretable predictors, but their quality is highly dependent on the particular choice of input features. Although neural networks can learn…

Machine Learning · Computer Science 2025-10-17 Gabriel Poesia , Georgia Gabriela Sampaio

In this work, we develop a new learning-based method for selecting facts (premises) when proving new goals over large formal libraries. Unlike previous methods that choose sets of facts independently of each other by their rank, the new…

Logic in Computer Science · Computer Science 2020-04-20 Bartosz Piotrowski , Josef Urban

We tackle the problem of building explainable recommendation systems that are based on a per-user decision tree, with decision rules that are based on single attribute values. We build the trees by applying learned regression functions to…

Machine Learning · Computer Science 2019-12-20 Eyal Shulman , Lior Wolf

Personalised education is one of the domains that can greatly benefit from the most recent advances in Artificial Intelligence (AI) and Large Language Models (LLM). However, it is also one of the most challenging applications due to the…

Computers and Society · Computer Science 2025-02-18 Sahan Bulathwela , Daniel Van Niekerk , Jarrod Shipton , Maria Perez-Ortiz , Benjamin Rosman , John Shawe-Taylor

The use of machine learning algorithms is an attractive way to produce very fast detector simulations for scattering reactions that can otherwise be computationally expensive. Here we develop a factorised approach where we deal with each…

Data Analysis, Statistics and Probability · Physics 2022-07-26 D. Darulis , R. Tyson , D. G. Ireland , D. I. Glazier , B. McKinnon , P. Pauli

Domain adaptation faces a fundamental paradox in the cold-start regime. When target data is scarce, statistical methods fail to distinguish relevant source domains from irrelevant ones, which often leads to negative transfer. In this paper,…

Machine Learning · Computer Science 2026-05-15 Qiyuan Chen , Jiayu Zhou , Raed Al Kontar

Recently, the use of machine learning in meteorology has increased greatly. While many machine learning methods are not new, university classes on machine learning are largely unavailable to meteorology students and are not required to…

Atmospheric and Oceanic Physics · Physics 2022-08-16 Randy J. Chase , David R. Harrison , Amanda Burke , Gary M. Lackmann , Amy McGovern

Prediction-oriented machine learning is becoming increasingly valuable to organizations, as it may drive applications in crucial business areas. However, decision-makers from companies across various industries are still largely reluctant…

Software Engineering · Computer Science 2023-06-22 Giacomo Welsch , Peter Kowalczyk

Data-efficient learning algorithms are essential in many practical applications where data collection is expensive, e.g., in robotics due to the wear and tear. To address this problem, meta-learning algorithms use prior experience about…

Machine Learning · Computer Science 2020-10-26 Jean Kaddour , Steindór Sæmundsson , Marc Peter Deisenroth

Providing user-understandable explanations to justify recommendations could help users better understand the recommended items, increase the system's ease of use, and gain users' trust. A typical approach to realize it is natural language…

Information Retrieval · Computer Science 2023-01-16 Lei Li , Yongfeng Zhang , Li Chen

We consider the task of automated theorem proving, a key AI task. Deep learning has shown promise for training theorem provers, but there are limited human-written theorems and proofs available for supervised learning. To address this…

Logic in Computer Science · Computer Science 2020-11-02 Mingzhe Wang , Jia Deng

Automated theorem provers and formal proof assistants are general reasoning systems that are in theory capable of proving arbitrarily hard theorems, thus solving arbitrary problems reducible to mathematics and logical reasoning. In…

Artificial Intelligence · Computer Science 2025-06-23 Lasse Blaauwbroek , David Cerna , Thibault Gauthier , Jan Jakubův , Cezary Kaliszyk , Martin Suda , Josef Urban