USPTO-50k

Dataset Card for "uspto-50k" More Information needed

Papers using USPTO-50k (16)

Representation-Guided Discrete Molecular Graph Retrosynthesis2026A Pre-trained Reaction Embedding Descriptor Capturing Bond Transformation Patterns2026 · 1 citesReasoning-Driven Retrosynthesis Prediction with Large Language Models via Reinforcement Learning2025 · 2 citesEnhancing Chemical Reaction and Retrosynthesis Prediction with Large Language Model and Dual-task Learning2025 · 2 citesOrder Matters in Retrosynthesis: Structure-aware Generation via Reaction-Center-Guided Discrete Flow Matching2026Template-Free Retrosynthesis with Graph-Prior Augmented Transformers2025Copy-Augmented Representation for Structure Invariant Template-Free Retrosynthesis2025A Large Language Model for Chemistry and Retrosynthesis Predictions2025SynBridge: Bridging Reaction States via Discrete Flow for Bidirectional Reaction Prediction2025Retro3D: A 3D-aware Template-free Method for Enhancing Retrosynthesis via Molecular Conformer Information2025Retrosynthesis Prediction with Local Template Retrieval2023 · 12 citesG-MATT: Single-step Retrosynthesis Prediction using Molecular Grammar Tree Transformer2023 · 10 citesModels Matter: The Impact of Single-Step Retrosynthesis on Synthesis Planning2023 · 6 citesRetrosynthesis prediction enhanced by in-silico reaction data augmentation2024 · 4 citesMotifRetro: Exploring the Combinability-Consistency Trade-offs in retrosynthesis via Dynamic Motif Editing2023 · 1 citesNode-Aligned Graph-to-Graph (NAG2G): Elevating Template-Free Deep Learning Approaches in Single-Step Retrosynthesis2023 · 1 cites