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Clevert, Djork-Arné
13 publications
NeurIPS
2025
Diffusion Generative Modeling on Lie Group Representations
Marco Bertolini
,
Tuan Le
,
Djork-Arné Clevert
ICLRW
2025
FLOWR -- Flow Matching for Structure- and Interaction-Aware De Novo Ligand Generation
Julian Cremer
,
Ross Irwin
,
Alessandro Tibo
,
Jon Paul Janet
,
Simon Olsson
,
Djork-Arné Clevert
ICLR
2025
KGARevion: An AI Agent for Knowledge-Intensive Biomedical QA
Xiaorui Su
,
Yibo Wang
,
Shanghua Gao
,
Xiaolong Liu
,
Valentina Giunchiglia
,
Djork-Arné Clevert
,
Marinka Zitnik
ICMLW
2024
Accelerating the Inference of String Generation-Based Chemical Reaction Models for Industrial Applications
Mikhail Andronov
,
Natalia Andronova
,
Michael Wand
,
Djork-Arné Clevert
,
Jürgen Schmidhuber
ICMLW
2024
Latent-Guided Equivariant Diffusion for Controlled Structure-Based De Novo Ligand Generation
Tuan Le
,
Julian Cremer
,
Djork-Arné Clevert
,
Kristof T Schütt
ICMLW
2024
Multi-Objective Guidance via Importance Sampling for Target-Aware Diffusion-Based De Novo Ligand Generation
Julian Cremer
,
Tuan Le
,
Frank Noe
,
Djork-Arné Clevert
,
Kristof T Schütt
ICLR
2024
Navigating the Design Space of Equivariant Diffusion-Based Generative Models for De Novo 3D Molecule Generation
Tuan Le
,
Julian Cremer
,
Frank Noe
,
Djork-Arné Clevert
,
Kristof T Schütt
LoG
2022
Representation Learning on Biomolecular Structures Using Equivariant Graph Attention
Tuan Le
,
Frank Noe
,
Djork-Arné Clevert
NeurIPS
2022
Unsupervised Learning of Group Invariant and Equivariant Representations
Robin Winter
,
Marco Bertolini
,
Tuan Le
,
Frank Noe
,
Djork-Arné Clevert
ICML
2021
Improving Molecular Graph Neural Network Explainability with Orthonormalization and Induced Sparsity
Ryan Henderson
,
Djork-Arné Clevert
,
Floriane Montanari
NeurIPS
2021
Permutation-Invariant Variational Autoencoder for Graph-Level Representation Learning
Robin Winter
,
Frank Noe
,
Djork-Arné Clevert
ICLR
2016
Fast and Accurate Deep Network Learning by Exponential Linear Units (ELUs)
Djork-Arné Clevert
,
Thomas Unterthiner
,
Sepp Hochreiter
NeurIPS
2015
Rectified Factor Networks
Djork-Arné Clevert
,
Andreas Mayr
,
Thomas Unterthiner
,
Sepp Hochreiter