Rui Jiao
10 papers · 2021–2025 · 5 venues · across top CS/AI venues
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Achievements
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π£ Hot Topic Early Bird π Conference Polyglot Β· Silver π Interdisciplinary Bridge Β· Bronze πΊοΈ Taxonomy Completionist (12) π Keyword Champion (2)
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Grand Slam
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Triple Crown
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Century Club Β· Bronze
Venues
Top co-authors
Research topics
Keywords
diffusion model
(2)
crystal structure prediction
(2)
equivariant diffusion
(2)
generative model
(2)
autoencoders
(1)
zero-shot generation
(1)
flow matching
(1)
molecular graph
(1)
diffusion process
(1)
latent space
(1)
denoising model
(1)
molecular representation
(1)
variational autoencoder
(1)
geometric constraint
(1)
molecular property prediction
(1)
permutation equivariance
(1)
crystal structure
(1)
noise distribution
(1)
material design
(1)
geometric deep learning
(1)
Papers
DenoiseVAE: Learning Molecule-Adaptive Noise Distributions for Denoising-based 3D Molecular Pre-training
ICLR 2025
UniMoMo: Unified Generative Modeling of 3D Molecules for De Novo Binder Design
ICML 2025
Zero-Shot Cyclic Peptide Design via Composable Geometric Constraints
ICML 2025
3D Structure Prediction of Atomic Systems with Flow-based Direct Preference Optimization
NeurIPS 2024
Equivariant Diffusion for Crystal Structure Prediction
ICML 2024
Learning Superconductivity from Ordered and Disordered Material Structures
NeurIPS 2024
Space Group Constrained Crystal Generation
ICLR 2024
Crystal Structure Prediction by Joint Equivariant Diffusion
NeurIPS 2023
Energy-Motivated Equivariant Pretraining for 3D Molecular Graphs
AAAI 2023
Alternated Training with Synthetic and Authentic Data for Neural Machine Translation
ACL 2021