Image de couverture de livre

InversionGNN: A Dual Path Network for Multi-Property Molecular Optimization

Fuente: arXiv

Enregistré dans:

Détails bibliographiques
Auteurs principaux:	Niu, Yifan, Gao, Ziqi, Xu, Tingyang, Liu, Yang, Bian, Yatao, Rong, Yu, Huang, Junzhou, Li, Jia
Format:	Preprint
Publié:	2025
Sujets:	Machine Learning
Accès en ligne:	Acceder al recurso
Tags:	Ajouter un tag Pas de tags, Soyez le premier à ajouter un tag!

Documents similaires

Natural Language-Assisted Multi-modal Medication Recommendation
par: Tan, Jie, et autres
Publié: (2025)

Attacking and Securing Community Detection: A Game-Theoretic Framework
par: Niu, Yifan, et autres
Publié: (2025)

IBCircuit: Towards Holistic Circuit Discovery with Information Bottleneck
par: Bian, Tian, et autres
Publié: (2026)

SEGNO: Generalizing Equivariant Graph Neural Networks with Physical Inductive Biases
par: Liu, Yang, et autres
Publié: (2023)

Energy-Guided Generative Modeling for Low-Energy Molecular Structure Discovery
par: Xu, Guikun, et autres
Publié: (2025)

Dual-Schedule Inversion: Training- and Tuning-Free Inversion for Real Image Editing
par: Huang, Jiancheng, et autres
Publié: (2024)

DELST: Dual Entailment Learning for Hyperbolic Image-Gene Pretraining in Spatial Transcriptomics
par: Chen, Xulin, et autres
Publié: (2025)

Multi-RF Fusion with Multi-GNN Blending for Molecular Property Prediction
par: Bugaud, Zacharie
Publié: (2026)

SliceGX: Layer-wise GNN Explanation with Model-slicing
par: Zhu, Tingting, et autres
Publié: (2025)

Unpaired Multi-Domain Histopathology Virtual Staining using Dual Path Prompted Inversion
par: Xiong, Bing, et autres
Publié: (2024)

A Sparsity-Aware Autonomous Path Planning Accelerator with HW/SW Co-Design and Multi-Level Dataflow Optimization
par: Zhang, Yifan, et autres
Publié: (2025)

Communication Optimization for Decentralized Learning atop Bandwidth-limited Edge Networks
par: Sun, Tingyang, et autres
Publié: (2025)

How Interpretable Are Interpretable Graph Neural Networks?
par: Chen, Yongqiang, et autres
Publié: (2024)

Overlay-based Decentralized Federated Learning in Bandwidth-limited Networks
par: Huang, Yudi, et autres
Publié: (2024)

KA-GNN: Kolmogorov-Arnold Graph Neural Networks for Molecular Property Prediction
par: Li, Longlong, et autres
Publié: (2024)

STAR-R1: Spatial TrAnsformation Reasoning by Reinforcing Multimodal LLMs
par: Li, Zongzhao, et autres
Publié: (2025)

Graph Unitary Message Passing
par: Qiu, Haiquan, et autres
Publié: (2024)

Probing the Safety Response Boundary of Large Language Models via Unsafe Decoding Path Generation
par: Wang, Haoyu, et autres
Publié: (2024)

MTSP-LDP: A Framework for Multi-Task Streaming Data Publication under Local Differential Privacy
par: Liu, Chang, et autres
Publié: (2025)

Molecular Generative Adversarial Network with Multi-Property Optimization
par: Tang, Huidong, et autres
Publié: (2024)

Breaking the Correlation Plateau: On the Optimization and Capacity Limits of Attention-Based Regressors
par: Yan, Jingquan, et autres
Publié: (2026)

DiffSpectra: Molecular Structure Elucidation from Spectra using Diffusion Models
par: Wang, Liang, et autres
Publié: (2025)

Step-On-Feet Tuning: Scaling Self-Alignment of LLMs via Bootstrapping
par: Wang, Haoyu, et autres
Publié: (2024)

Lingshu-Cell: A generative cellular world model for transcriptome modeling toward virtual cells
par: Zhang, Han, et autres
Publié: (2026)

One Fits All: Learning Fair Graph Neural Networks for Various Sensitive Attributes
par: Zhu, Yuchang, et autres
Publié: (2024)

ADA-GNN: Atom-Distance-Angle Graph Neural Network for Crystal Material Property Prediction
par: Huang, Jiao, et autres
Publié: (2024)

Contrastive Dual-Interaction Graph Neural Network for Molecular Property Prediction
par: Zhao, Zexing, et autres
Publié: (2024)

ETDock: A Novel Equivariant Transformer for Protein-Ligand Docking
par: Yi, Yiqiang, et autres
Publié: (2023)

Mini-Game Lifetime Value Prediction in WeChat
par: Chen, Aochuan, et autres
Publié: (2025)

PathM3: A Multimodal Multi-Task Multiple Instance Learning Framework for Whole Slide Image Classification and Captioning
par: Zhou, Qifeng, et autres
Publié: (2024)

DML ‐ GNN : ASD Diagnosis Based on Dual‐Atlas Multi‐Feature Learning Graph Neural Network
par: Shuaiqi Liu, et autres
Publié: (2025)

Intensity and Phase correction Enhanced interferometric scattering microscopy (iSCAT)
par: Zhang, Xiang, et autres
Publié: (2025)

MDAS-GNN: Multi-Dimensional Spatiotemporal GNN with Spatial Diffusion for Urban Traffic Risk Forecasting
par: Gao, Ziyuan
Publié: (2025)

FADPNet: Frequency-Aware Dual-Path Network for Face Super-Resolution
par: Xu, Siyu, et autres
Publié: (2025)

DB-GNN: Dual-Branch Graph Neural Network with Multi-Level Contrastive Learning for Jointly Identifying Within- and Cross-Frequency Coupled Brain Networks
par: Wang, Xiang, et autres
Publié: (2025)

Large Language-Geometry Model: When LLM meets Equivariance
par: Li, Zongzhao, et autres
Publié: (2025)

CaT-GNN: Enhancing Credit Card Fraud Detection via Causal Temporal Graph Neural Networks
par: Duan, Yifan, et autres
Publié: (2024)

Learning to Learn with Contrastive Meta-Objective
par: Wu, Shiguang, et autres
Publié: (2024)

Multi-robot Task Allocation and Path Planning with Maximum Range Constraints
par: Xu, Gang, et autres
Publié: (2024)

MolViBench: Evaluating LLMs on Molecular Vibe Coding
par: Li, Jiatong, et autres
Publié: (2026)