activity
20122026
most citedOrbNet: Deep Learning for Quantum Chemistry Using Symmetry-Adapted Atomic-Orbital Features

245 citations · 783 across the 82 of their papers we have counts for

collaborators
Showing 2024Show all

37 papers · 1 filter

cs.LG2024★ 6 cited

A Library for Learning Neural Operators

Jean Kossaifi, Nikola Kovachki, Zongyi Li +8

We present NeuralOperator, an open-source Python library for operator learning. Neural operators generalize neural networks to maps between function spaces instead of finite-dimens…

stat.ML2024

Sequential Controlled Langevin Diffusions

Junhua Chen, Lorenz Richter, Julius Berner +3

An effective approach for sampling from unnormalized densities is based on the idea of gradually transporting samples from an easy prior to the complicated target distribution. Two…

eess.AS2024★ 1 cited

Automating Feedback Analysis in Surgical Training: Detection, Categorization, and Assessment

Firdavs Nasriddinov, Rafal Kocielnik, Arushi Gupta +4

This work introduces the first framework for reconstructing surgical dialogue from unstructured real-world recordings, which is crucial for characterizing teaching tasks. In surgic…

cs.LG2024★ 1 cited

Multi-Modal Self-Supervised Learning for Surgical Feedback Effectiveness Assessment

Arushi Gupta, Rafal Kocielnik, Jiayun Wang +5

During surgical training, real-time feedback from trainers to trainees is important for preventing errors and enhancing long-term skill acquisition. Accurately predicting the effec…

quant-ph2024

Extending Quantum Perceptrons: Rydberg Devices, Multi-Class Classification, and Error Tolerance

Ishita Agarwal, Taylor L. Patti, Rodrigo Araiza Bravo +2

Quantum Neuromorphic Computing (QNC) merges quantum computation with neural computation to create scalable, noise-resilient algorithms for quantum machine learning (QML). At the co…

cs.LG2024★ 11 cited

BioNeMo Framework: a modular, high-performance library for AI model development in drug discovery

Peter St. John, Dejun Lin, Polina Binder +89

Artificial Intelligence models encoding biology and chemistry are opening new routes to high-throughput and high-quality in-silico drug development. However, their training increas…