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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 6170 of 110 papers

TitleStatusHype
Enhancing Retrosynthesis with Conformer: A Template-Free Method0
Generating Molecules via Chemical Reactions0
G-MATT: Single-step Retrosynthesis Prediction using Molecular Grammar Tree Transformer0
Human-in-the-loop for a Disconnection Aware Retrosynthesis0
Learning Graph Models for Template-Free Retrosynthesis0
Learning to Make Generalizable and Diverse Predictions for Retrosynthesis0
Learning to Plan Chemical Syntheses0
LLM-Augmented Chemical Synthesis and Design Decision Programs0
MARS: A Motif-based Autoregressive Model for Retrosynthesis Prediction0
Mind the Retrosynthesis Gap: Bridging the divide between Single-step and Multi-step Retrosynthesis Prediction0
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