SOTAVerified

Retrosynthesis

Retrosynthetic analysis is a pivotal synthetic methodology in organic chemistry that employs a reverse-engineering approach, initiating from the target compound and retroactively tracing potential synthesis routes and precursor molecules. This technique proves instrumental in sculpting efficient synthetic strategies for intricate molecules, thus catalyzing the evolution and progression of novel pharmaceuticals and materials.

Papers

Showing 76100 of 110 papers

TitleStatusHype
PolyRetro: Few-shot Polymer Retrosynthesis via Domain Adaptation0
Predicting retrosynthetic pathways using a combined linguistic model and hyper-graph exploration strategy0
Quantum Machine Learning for Material Synthesis and Hardware Security0
RCsearcher: Reaction Center Identification in Retrosynthesis via Deep Q-Learning0
Recent advances in artificial intelligence for retrosynthesis0
RetCL: A Selection-based Approach for Retrosynthesis via Contrastive Learning0
RetroGNN: Approximating Retrosynthesis by Graph Neural Networks for De Novo Drug Design0
RetroOOD: Understanding Out-of-Distribution Generalization in Retrosynthesis Prediction0
Retro-prob: Retrosynthetic Planning Based on a Probabilistic Model0
Retro-Rank-In: A Ranking-Based Approach for Inorganic Materials Synthesis Planning0
RETRO SYNFLOW: Discrete Flow Matching for Accurate and Diverse Single-Step Retrosynthesis0
Retrosynthesis prediction enhanced by in-silico reaction data augmentation0
Retrosynthesis Prediction via Search in (Hyper) Graph0
Retrosynthesis Prediction with Local Template Retrieval0
Retrosynthesis with Attention-Based NMT Model and Chemical Analysis of the "Wrong" Predictions0
SemiRetro: Semi-template framework boosts deep retrosynthesis prediction0
Suitability of Large Language Models for Extraction of High-Quality Chemical Reaction Dataset from Patent Literature0
CogMol: Target-Specific and Selective Drug Design for COVID-19 Using Deep Generative Models0
Towards "AlphaChem": Chemical Synthesis Planning with Tree Search and Deep Neural Network Policies0
Towards understanding retrosynthesis by energy-based models0
RetroDiff: Retrosynthesis as Multi-stage Distribution Interpolation0
RetroComposer: Composing Templates for Template-Based Retrosynthesis PredictionCode0
Computer-Assisted Retrosynthesis Based on Molecular SimilarityCode0
Retro-BLEU: Quantifying Chemical Plausibility of Retrosynthesis Routes through Reaction Template Sequence AnalysisCode0
Preference Optimization for Molecule Synthesis with Conditional Residual Energy-based ModelsCode0
Show:102550
← PrevPage 4 of 5Next →

No leaderboard results yet.