2 results found Sort:

reymond-group
CASP-and-dataset-performance reymond-group
15
45
mit
12
Source code and documentation of a computer assisted synthesis planning (CASP) tool used for the analysis of reaction datasets.
casp datasets synthesis retrosynthesis synthesis-routes organic-chemistry computer-aided-drug-design
Created 2019-09-24
14 commits to master branch, last one 3 years ago
syngenta
linchemin syngenta
6
34
mit
4
Linked Chemical Information. LinChemIn is a Python toolkit that leverages the native connectivity of Chemical Reaction Data and provides actionable insights. The toolkit provides a program interface t...
casp python synthesis chemoinformatics
Created 2022-11-07
181 commits to main branch, last one about a year ago