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research article

Tango*: constrained synthesis planning using chemically informed value functions

Armstrong, Daniel  
•
Jončev, Zlatko
•
Guo, Jeff  
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2025
Digital Discovery

TANGO* enables starting material constrained synthesis planning using computed molecular similarity to guide retrosynthetic search toward specific starting materials, achieving superior performance to neural network approaches.

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10.1039_d5dd00130g.pdf

Type

Main Document

Version

Published version

Access type

openaccess

License Condition

CC BY

Size

1012.7 KB

Format

Adobe PDF

Checksum (MD5)

01c396fccdde1ab7f99e40c03d3a2643

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