Portrait de Yoshua Bengio

Yoshua Bengio

Membre académique principal
Chaire en IA Canada-CIFAR
Professeur titulaire, Université de Montréal, Département d'informatique et de recherche opérationnelle
Fondateur et Conseiller scientifique, Équipe de direction
Sujets de recherche
Apprentissage automatique médical
Apprentissage de représentations
Apprentissage par renforcement
Apprentissage profond
Causalité
Modèles génératifs
Modèles probabilistes
Modélisation moléculaire
Neurosciences computationnelles
Raisonnement
Réseaux de neurones en graphes
Réseaux de neurones récurrents
Théorie de l'apprentissage automatique
Traitement du langage naturel

Biographie

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Reconnu comme une sommité mondiale en intelligence artificielle, Yoshua Bengio s’est surtout distingué par son rôle de pionnier en apprentissage profond, ce qui lui a valu le prix A. M. Turing 2018, le « prix Nobel de l’informatique », avec Geoffrey Hinton et Yann LeCun. Il est professeur titulaire à l’Université de Montréal, fondateur et conseiller scientifique de Mila – Institut québécois d’intelligence artificielle, et codirige en tant que senior fellow le programme Apprentissage automatique, apprentissage biologique de l'Institut canadien de recherches avancées (CIFAR). Il occupe également la fonction de conseiller spécial et directeur scientifique fondateur d’IVADO.

En 2018, il a été l’informaticien qui a recueilli le plus grand nombre de nouvelles citations au monde. En 2019, il s’est vu décerner le prestigieux prix Killam. Depuis 2022, il détient le plus grand facteur d’impact (h-index) en informatique à l’échelle mondiale. Il est fellow de la Royal Society de Londres et de la Société royale du Canada, et officier de l’Ordre du Canada.

Soucieux des répercussions sociales de l’IA et de l’objectif que l’IA bénéficie à tous, il a contribué activement à la Déclaration de Montréal pour un développement responsable de l’intelligence artificielle.

Publications

Were RNNs All We Needed?
Frederick Tung
Mohamed Osama Ahmed
Hossein Hajimirsadeghi
The introduction of Transformers in 2017 reshaped the landscape of deep learning. Originally proposed for sequence modelling, Transformers h… (voir plus)ave since achieved widespread success across various domains. However, the scalability limitations of Transformers - particularly with respect to sequence length - have sparked renewed interest in novel recurrent models that are parallelizable during training, offer comparable performance, and scale more effectively. In this work, we revisit sequence modelling from a historical perspective, focusing on Recurrent Neural Networks (RNNs), which dominated the field for two decades before the rise of Transformers. Specifically, we examine LSTMs (1997) and GRUs (2014). We demonstrate that by simplifying these models, we can derive minimal versions (minLSTMs and minGRUs) that (1) use fewer parameters than their traditional counterparts, (2) are fully parallelizable during training, and (3) achieve surprisingly competitive performance on a range of tasks, rivalling recent models including Transformers.
MAP: Model Merging with Amortized Pareto Front Using Limited Computation
Li Li
Zhiqi Bu
Huan He
Yonghui Wu
Jiang Bian
Yong Chen
Amortizing intractable inference in diffusion models for vision, language, and control
Diffusion models have emerged as effective distribution estimators in vision, language, and reinforcement learning, but their use as priors … (voir plus)in downstream tasks poses an intractable posterior inference problem. This paper studies amortized sampling of the posterior over data,
Improved off-policy training of diffusion samplers
We study the problem of training diffusion models to sample from a distribution with a given unnormalized density or energy function. We ben… (voir plus)chmark several diffusion-structured inference methods, including simulation-based variational approaches and off-policy methods (continuous generative flow networks). Our results shed light on the relative advantages of existing algorithms while bringing into question some claims from past work. We also propose a novel exploration strategy for off-policy methods, based on local search in the target space with the use of a replay buffer, and show that it improves the quality of samples on a variety of target distributions. Our code for the sampling methods and benchmarks studied is made public at https://github.com/GFNOrg/gfn-diffusion as a base for future work on diffusion models for amortized inference.
Metacognitive Capabilities of LLMs: An Exploration in Mathematical Problem Solving
Nan Rosemary Ke
Siyuan Guo
Michal Valko
Timothy Lillicrap
Danilo Rezende
Michael Mozer
Sanjeev Arora
Metacognitive knowledge refers to humans' intuitive knowledge of their own thinking and reasoning processes. Today's best LLMs clearly posse… (voir plus)ss some reasoning processes. The paper gives evidence that they also have metacognitive knowledge, including ability to name skills and procedures to apply given a task. We explore this primarily in context of math reasoning, developing a prompt-guided interaction procedure to get a powerful LLM to assign sensible skill labels to math questions, followed by having it perform semantic clustering to obtain coarser families of skill labels. These coarse skill labels look interpretable to humans. To validate that these skill labels are meaningful and relevant to the LLM's reasoning processes we perform the following experiments. (a) We ask GPT-4 to assign skill labels to training questions in math datasets GSM8K and MATH. (b) When using an LLM to solve the test questions, we present it with the full list of skill labels and ask it to identify the skill needed. Then it is presented with randomly selected exemplar solved questions associated with that skill label. This improves accuracy on GSM8k and MATH for several strong LLMs, including code-assisted models. The methodology presented is domain-agnostic, even though this article applies it to math problems.
RGFN: Synthesizable Molecular Generation Using GFlowNets
Andrei Rekesh
Dmytro Shevchuk
Cheng-Hao Liu
Mike Tyers
Robert A. Batey
Generative models hold great promise for small molecule discovery, significantly increasing the size of search space compared to traditional… (voir plus) in silico screening libraries. However, most existing machine learning methods for small molecule generation suffer from poor synthesizability of candidate compounds, making experimental validation difficult. In this paper we propose Reaction-GFlowNet (RGFN), an extension of the GFlowNet framework that operates directly in the space of chemical reactions, thereby allowing out-of-the-box synthesizability while maintaining comparable quality of generated candidates. We demonstrate that with the proposed set of reactions and building blocks, it is possible to obtain a search space of molecules orders of magnitude larger than existing screening libraries coupled with low cost of synthesis. We also show that the approach scales to very large fragment libraries, further increasing the number of potential molecules. We demonstrate the effectiveness of the proposed approach across a range of oracle models, including pretrained proxy models and GPU-accelerated docking.
Al content detection in the emerging information ecosystem: new obligations for media and tech companies
Alistair Knott
Dino Pedreschi
Toshiya Jitsuzumi
Susan Leavy
David Eyers
Tapabrata Chakraborti
Andrew Trotman
Sundar Sundareswaran
Ricardo Baeza-Yates
Przemyslaw Biecek
Adrian Weller
Paul D. Teal
Subhadip Basu
Mehmet Haklidir
Virginia Morini
Stuart Russell
A high-throughput phenotypic screen combined with an ultra-large-scale deep learning-based virtual screening reveals novel scaffolds of antibacterial compounds
Gabriele Scalia
Steven T. Rutherford
Ziqing Lu
Kerry R. Buchholz
Nicholas Skelton
Kangway Chuang
Nathaniel Diamant
Jan-Christian Hütter
Jerome-Maxim Luescher
Anh Miu
Jeff Blaney
Leo Gendelev
Elizabeth Skippington
Greg Zynda
Nia Dickson
Aviv Regev
Man-Wah Tan
Tommaso Biancalani
The proliferation of multi-drug-resistant bacteria underscores an urgent need for novel antibiotics. Traditional discovery methods face chal… (voir plus)lenges due to limited chemical diversity, high costs, and difficulties in identifying structurally novel compounds. Here, we explore the integration of small molecule high-throughput screening with a deep learning-based virtual screening approach to uncover new antibacterial compounds. Leveraging a diverse library of nearly 2 million small molecules, we conducted comprehensive phenotypic screening against a sensitized Escherichia coli strain that, at a low hit rate, yielded thousands of hits. We trained a deep learning model, GNEprop, to predict antibacterial activity, ensuring robustness through out-of-distribution generalization techniques. Virtual screening of over 1.4 billion compounds identified potential candidates, of which 82 exhibited antibacterial activity, illustrating a 90X improved hit rate over the high-throughput screening experiment GNEprop was trained on. Importantly, a significant portion of these newly identified compounds exhibited high dissimilarity to known antibiotics, indicating promising avenues for further exploration in antibiotic discovery.
Zero-Shot Object-Centric Representation Learning
Aniket Rajiv Didolkar
Andrii Zadaianchuk
Michael Curtis Mozer
Georg Martius
Maximilian Seitzer
The goal of object-centric representation learning is to decompose visual scenes into a structured representation that isolates the entities… (voir plus). Recent successes have shown that object-centric representation learning can be scaled to real-world scenes by utilizing pre-trained self-supervised features. However, so far, object-centric methods have mostly been applied in-distribution, with models trained and evaluated on the same dataset. This is in contrast to the wider trend in machine learning towards general-purpose models directly applicable to unseen data and tasks. Thus, in this work, we study current object-centric methods through the lens of zero-shot generalization by introducing a benchmark comprising eight different synthetic and real-world datasets. We analyze the factors influencing zero-shot performance and find that training on diverse real-world images improves transferability to unseen scenarios. Furthermore, inspired by the success of task-specific fine-tuning in foundation models, we introduce a novel fine-tuning strategy to adapt pre-trained vision encoders for the task of object discovery. We find that the proposed approach results in state-of-the-art performance for unsupervised object discovery, exhibiting strong zero-shot transfer to unseen datasets.
Multi-Fidelity Active Learning with GFlowNets
Moksh J. Jain
Cheng-Hao Liu
In the last decades, the capacity to generate large amounts of data in science and engineering applications has been growing steadily. Meanw… (voir plus)hile, the progress in machine learning has turned it into a suitable tool to process and utilise the available data. Nonetheless, many relevant scientific and engineering problems present challenges where current machine learning methods cannot yet efficiently leverage the available data and resources. For example, in scientific discovery, we are often faced with the problem of exploring very large, high-dimensional spaces, where querying a high fidelity, black-box objective function is very expensive. Progress in machine learning methods that can efficiently tackle such problems would help accelerate currently crucial areas such as drug and materials discovery. In this paper, we propose the use of GFlowNets for multi-fidelity active learning, where multiple approximations of the black-box function are available at lower fidelity and cost. GFlowNets are recently proposed methods for amortised probabilistic inference that have proven efficient for exploring large, high-dimensional spaces and can hence be practical in the multi-fidelity setting too. Here, we describe our algorithm for multi-fidelity active learning with GFlowNets and evaluate its performance in both well-studied synthetic tasks and practically relevant applications of molecular discovery. Our results show that multi-fidelity active learning with GFlowNets can efficiently leverage the availability of multiple oracles with different costs and fidelities to accelerate scientific discovery and engineering design.
Redesigning Information Markets in the Era of Language Models
Nasim Rahaman
Manuel Wuthrich
Li Erran Li
Bernhard Schölkopf
Christopher Pal
Improving Gradient-Guided Nested Sampling for Posterior Inference
We present a performant, general-purpose gradient-guided nested sampling algorithm, …