/tools/CASP-and-dataset-performance
CASP-and-dataset-performance
reymond-group/CASP-and-dataset-performance
48 stars15 forksJupyter NotebookAdded February 8, 2026
summary
This repository contains source code and documentation for a computer-assisted synthesis planning tool used to analyze reaction datasets in organic chemistry. It facilitates the extraction of templates and the training of policies for synthetic route generation.
description
Source code and documentation of a computer assisted synthesis planning (CASP) tool used for the analysis of reaction datasets.
topics
retrosynthesissynthesis-routessynthesisorganic-chemistrycomputer-aided-drug-designcaspdatasets
Ratings
N/A
0 ratings
Rate this tool: