Minkai Xu

Orcid: 0009-0007-9735-3767

According to our database1, Minkai Xu authored at least 32 papers between 2020 and 2024.

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Bibliography

2024
Cross-Modal Contextualized Diffusion Models for Text-Guided Visual Generation and Editing.
CoRR, 2024

RealCompo: Dynamic Equilibrium between Realism and Compositionality Improves Text-to-Image Diffusion Models.
CoRR, 2024

Mastering Text-to-Image Diffusion: Recaptioning, Planning, and Generating with Multimodal LLMs.
CoRR, 2024

Equivariant Graph Neural Operator for Modeling 3D Dynamics.
CoRR, 2024

2023
Equivariant Flow Matching with Hybrid Probability Transport.
CoRR, 2023

RetroDiff: Retrosynthesis as Multi-stage Distribution Interpolation.
CoRR, 2023

Scaling Riemannian Diffusion Models.
CoRR, 2023

VQGraph: Graph Vector-Quantization for Bridging GNNs and MLPs.
CoRR, 2023

Artificial Intelligence for Science in Quantum, Atomistic, and Continuum Systems.
CoRR, 2023

MADiff: Offline Multi-agent Learning with Diffusion Models.
CoRR, 2023

MUDiff: Unified Diffusion for Complete Molecule Generation.
CoRR, 2023

Equivariant Flow Matching with Hybrid Probability Transport for 3D Molecule Generation.
Proceedings of the Advances in Neural Information Processing Systems 36: Annual Conference on Neural Information Processing Systems 2023, 2023

When Do Graph Neural Networks Help with Node Classification? Investigating the Homophily Principle on Node Distinguishability.
Proceedings of the Advances in Neural Information Processing Systems 36: Annual Conference on Neural Information Processing Systems 2023, 2023

Scaling Riemannian Diffusion Models.
Proceedings of the Advances in Neural Information Processing Systems 36: Annual Conference on Neural Information Processing Systems 2023, 2023

Graph and Geometry Generative Modeling for Drug Discovery.
Proceedings of the 29th ACM SIGKDD Conference on Knowledge Discovery and Data Mining, 2023

Geometric Latent Diffusion Models for 3D Molecule Generation.
Proceedings of the International Conference on Machine Learning, 2023

Coarse-to-Fine: a Hierarchical Diffusion Model for Molecule Generation in 3D.
Proceedings of the International Conference on Machine Learning, 2023

FusionRetro: Molecule Representation Fusion via In-Context Learning for Retrosynthetic Planning.
Proceedings of the International Conference on Machine Learning, 2023

2022
Generative Coarse-Graining of Molecular Conformations.
Proceedings of the International Conference on Machine Learning, 2022

GeoDiff: A Geometric Diffusion Model for Molecular Conformation Generation.
Proceedings of the Tenth International Conference on Learning Representations, 2022

2021
Predicting Molecular Conformation via Dynamic Graph Score Matching.
Proceedings of the Advances in Neural Information Processing Systems 34: Annual Conference on Neural Information Processing Systems 2021, 2021

An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming.
Proceedings of the 38th International Conference on Machine Learning, 2021

Learning Gradient Fields for Molecular Conformation Generation.
Proceedings of the 38th International Conference on Machine Learning, 2021

Learning Neural Generative Dynamics for Molecular Conformation Generation.
Proceedings of the 9th International Conference on Learning Representations, 2021

Energy-Based Imitation Learning.
Proceedings of the AAMAS '21: 20th International Conference on Autonomous Agents and Multiagent Systems, 2021

Towards Generalized Implementation of Wasserstein Distance in GANs.
Proceedings of the Thirty-Fifth AAAI Conference on Artificial Intelligence, 2021

2020
Sobolev Wasserstein GAN.
CoRR, 2020

Reciprocal Supervised Learning Improves Neural Machine Translation.
CoRR, 2020

Discriminator Contrastive Divergence: Semi-Amortized Generative Modeling by Exploring Energy of the Discriminator.
CoRR, 2020

A Graph to Graphs Framework for Retrosynthesis Prediction.
Proceedings of the 37th International Conference on Machine Learning, 2020

GraphAF: a Flow-based Autoregressive Model for Molecular Graph Generation.
Proceedings of the 8th International Conference on Learning Representations, 2020

Infomax Neural Joint Source-Channel Coding via Adversarial Bit Flip.
Proceedings of the Thirty-Fourth AAAI Conference on Artificial Intelligence, 2020


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