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Machine Learning Interatomic Potentials play a fundamental role in computational chemistry and materials science, enabling applications from molecular dynamics simulations to drug design and materials discovery. While recent approaches can…

Machine Learning · Computer Science 2026-05-12 Amir Masoud Nourollah , Irtaza Khalid , Stefano Leoni , Steven Schockaert

Complex, long-horizon planning and its combinatorial nature pose steep challenges for learning-based agents. Difficulties in such settings are exacerbated in low data regimes where over-fitting stifles generalization and compounding errors…

Machine Learning · Computer Science 2023-06-23 Joey Hejna , Pieter Abbeel , Lerrel Pinto

The utilization of broad datasets has proven to be crucial for generalization for a wide range of fields. However, how to effectively make use of diverse multi-task data for novel downstream tasks still remains a grand challenge in…

Robotics · Computer Science 2023-04-19 Kuan Fang , Patrick Yin , Ashvin Nair , Homer Walke , Gengchen Yan , Sergey Levine

Imitation learning has gained immense popularity because of its high sample-efficiency. However, in real-world scenarios, where the trajectory distribution of most of the tasks dynamically shifts, model fitting on continuously aggregated…

Machine Learning · Computer Science 2023-07-04 Kiran Lekkala , Sami Abu-El-Haija , Laurent Itti

We equip a smaller Language Model to generalise to answering challenging compositional questions that have not been seen in training. To do so we propose a combination of multitask supervised pretraining on up to 93 tasks designed to…

Computation and Language · Computer Science 2023-08-22 Tim Hartill , Neset Tan , Michael Witbrock , Patricia J. Riddle

We tackle real-world problems with complex structures beyond the pixel-based game or simulator. We formulate it as a few-shot reinforcement learning problem where a task is characterized by a subtask graph that defines a set of subtasks and…

Machine Learning · Computer Science 2022-05-26 Sungryull Sohn , Hyunjae Woo , Jongwook Choi , lyubing qiang , Izzeddin Gur , Aleksandra Faust , Honglak Lee

In the same way that generative models today conduct most of their training in a self-supervised fashion, how can agentic models conduct their training in a self-supervised fashion, interactively exploring, learning, and preparing to…

Machine Learning · Computer Science 2025-10-21 Kathryn Wantlin , Chongyi Zheng , Benjamin Eysenbach

The ability to build a model on a source task and subsequently adapt such model on a new target task is a pervasive need in many astronomical applications. The problem is generally known as transfer learning in machine learning, where…

Machine Learning · Computer Science 2019-09-25 Ricardo Vilalta , Kinjal Dhar Gupta , Dainis Boumber , Mikhail M. Meskhi

Neural networks can be powerful function approximators, which are able to model high-dimensional feature distributions from a subset of examples drawn from the target distribution. Naturally, they perform well at generalizing within the…

Machine Learning · Computer Science 2021-08-06 Aaron Eisermann , Jae Hee Lee , Cornelius Weber , Stefan Wermter

In this paper, we study imitation learning under the challenging setting of: (1) only a single demonstration, (2) no further data collection, and (3) no prior task or object knowledge. We show how, with these constraints, imitation learning…

Robotics · Computer Science 2023-10-19 Pietro Vitiello , Kamil Dreczkowski , Edward Johns

Compositional reinforcement learning is a promising approach for training policies to perform complex long-horizon tasks. Typically, a high-level task is decomposed into a sequence of subtasks and a separate policy is trained to perform…

Machine Learning · Computer Science 2023-06-09 Kishor Jothimurugan , Steve Hsu , Osbert Bastani , Rajeev Alur

We provide a study of how induced model sparsity can help achieve compositional generalization and better sample efficiency in grounded language learning problems. We consider simple language-conditioned navigation problems in a grid world…

Computation and Language · Computer Science 2022-07-07 Sam Spilsbury , Alexander Ilin

Single-image 3D shape reconstruction is an important and long-standing problem in computer vision. A plethora of existing works is constantly pushing the state-of-the-art performance in the deep learning era. However, there remains a much…

Computer Vision and Pattern Recognition · Computer Science 2021-04-23 Songfang Han , Jiayuan Gu , Kaichun Mo , Li Yi , Siyu Hu , Xuejin Chen , Hao Su

Compositional generalization refers to correctly interpret novel combinations of known primitives, which remains a major challenge. Existing approaches often rely on supervised fine-tuning, which encourages models to imitate target outputs.…

Machine Learning · Computer Science 2026-05-07 Xiyan Fu , Wei Liu

Recent developments in imitation learning have considerably advanced robotic manipulation. However, current techniques in imitation learning can suffer from poor generalization, limiting performance even under relatively minor domain…

Robotics · Computer Science 2025-07-31 Yifei Chen , Yuzhe Zhang , Giovanni D'urso , Nicholas Lawrance , Brendan Tidd

A grand goal in AI is to build a robot that can accurately navigate based on natural language instructions, which requires the agent to perceive the scene, understand and ground language, and act in the real-world environment. One key…

Computation and Language · Computer Science 2019-04-09 Hao Tan , Licheng Yu , Mohit Bansal

A long-standing challenge in Reinforcement Learning is enabling agents to learn a model of their environment which can be transferred to solve other problems in a world with the same underlying rules. One reason this is difficult is the…

Machine Learning · Computer Science 2019-05-16 Kai Olav Ellefsen , Jim Torresen

For an autonomous agent to fulfill a wide range of user-specified goals at test time, it must be able to learn broadly applicable and general-purpose skill repertoires. Furthermore, to provide the requisite level of generality, these skills…

Machine Learning · Computer Science 2018-12-05 Ashvin Nair , Vitchyr Pong , Murtaza Dalal , Shikhar Bahl , Steven Lin , Sergey Levine

Recently, graph-based planning algorithms have gained much attention to solve goal-conditioned reinforcement learning (RL) tasks: they provide a sequence of subgoals to reach the target-goal, and the agents learn to execute…

Machine Learning · Computer Science 2023-03-21 Junsu Kim , Younggyo Seo , Sungsoo Ahn , Kyunghwan Son , Jinwoo Shin

Compositional generalization is a basic and essential intellective capability of human beings, which allows us to recombine known parts readily. However, existing neural network based models have been proven to be extremely deficient in…

Artificial Intelligence · Computer Science 2020-10-27 Qian Liu , Shengnan An , Jian-Guang Lou , Bei Chen , Zeqi Lin , Yan Gao , Bin Zhou , Nanning Zheng , Dongmei Zhang