Publication

Gaussian Process Regression for Materials and Molecules

Publications associées (49)

Graph Chatbot

Chattez avec Graph Search

Posez n’importe quelle question sur les cours, conférences, exercices, recherches, actualités, etc. de l’EPFL ou essayez les exemples de questions ci-dessous.

AVERTISSEMENT : Le chatbot Graph n'est pas programmé pour fournir des réponses explicites ou catégoriques à vos questions. Il transforme plutôt vos questions en demandes API qui sont distribuées aux différents services informatiques officiellement administrés par l'EPFL. Son but est uniquement de collecter et de recommander des références pertinentes à des contenus que vous pouvez explorer pour vous aider à répondre à vos questions.

Connectez-vous pour utiliser Chat avec Graph Search

Distributional Regression and Autoregression via Optimal Transport

Laya Ghodrati

We present a framework for performing regression when both covariate and response are probability distributions on a compact and convex subset of

\R^d

. Our regression model is based on the theory of optimal transport and links the conditional Fr'echet m ...

EPFL2023

Bayes-optimal Learning of Deep Random Networks of Extensive-width

Florent Gérard Krzakala, Lenka Zdeborová, Hugo Chao Cui

We consider the problem of learning a target function corresponding to a deep, extensive-width, non-linear neural network with random Gaussian weights. We consider the asymptotic limit where the number of samples, the input dimension and the network width ...

2023

Time has always been a central factor in understanding the challenges of daily mobility. For a long time, and still today, methods of economic evaluation of transport projects have monetized time savings so that they can be included in the cost–benefit ana ...

ISTE Wiley2023

Roadmap on Machine learning in electronic structure

Michele Ceriotti, Jigyasa Nigam, Andrea Grisafi, Max David Veit

In recent years, we have been witnessing a paradigm shift in computational materials science. In fact, traditional methods, mostly developed in the second half of the XXth century, are being complemented, extended, and sometimes even completely replaced by ...

IOP Publishing Ltd2022

We present a framework for performing regression when both covariate and response are probability distributions on a compact interval. Our regression model is based on the theory of optimal transportation, and links the conditional Frechet mean of the resp ...

OXFORD UNIV PRESS2022

Minimax rate for optimal transport regression between distributions

Victor Panaretos, Laya Ghodrati

Distribution-on-distribution regression considers the problem of formulating and es-timating a regression relationship where both covariate and response are probability distributions. The optimal transport distributional regression model postulates that th ...

ELSEVIER2022

Physics-Inspired Structural Representations for Molecules and Materials

Michele Ceriotti, Félix Benedito Clément Musil, Andrea Grisafi

The first step in the construction of a regression model or a data-driven analysis, aiming to predict or elucidate the relationship between the atomic-scale structure of matter and its properties, involves transforming the Cartesian coordinates of the atom ...

AMER CHEMICAL SOC2021

Deep Learning with Convolutional Neural Network for Proportional Control of Finger Movements from surface EMG Recordings

Silvestro Micera, Vincent Alexandre Mendez, Leonardo Pollina, Fiorenzo Artoni

The control of robotic prosthetic hands (RPHs) for upper limb amputees is far from optimal. Simultaneous and proportional finger control of a RPH based on EMG signals is still challenging. Based on EMG and kinematics recordings of subjects following a pre- ...

IEEE2021

Linear regression analysis of regional mean speed of Athens city network using drone data: A multi-modal approach

Nikolaos Geroliminis, Emmanouil Barmpounakis

The work proposes a multi-modal regional mean speed regression analysis for the city network of Athens, Greece. The dataset from pNUEMA experiment is used in the present context. Accumulations and mean speeds of different modes are estimated and compared t ...

2021

The Birth of a New Field: Memristive Sensors. A Review

Sandro Carrara

Over the last 11 years, the field of Memristive Sensors abruptly emerged in literature. The present review paper has the aim to acknowledge such an exciting new field of research as well as to critically review its most significant outcomes. As usual in sc ...

IEEE-INST ELECTRICAL ELECTRONICS ENGINEERS INC2021

Distributional Regression and Autoregression via Optimal Transport

Laya Ghodrati

We present a framework for performing regression when both covariate and response are probability distributions on a compact and convex subset of

\R^d

. Our regression model is based on the theory of optimal transport and links the conditional Fr'echet m ...

EPFL2023