Automatic generation of Markush structures from specific compounds
Posted by
Péter Kovács
on 2019-09-03
Markush structures play an important role in cheminformatics, especially in chemical patents. Our recent publication presents a novel algorithm for automatically generating Markush structures from series of specific compounds. This method can effectively be used to assist patent drafting or to compose combinatorial libraries based on several molecules of interest. The presented algorithm is the first solution to this problem, which is available in multiple software products of ChemAxon.
You can access the full paper in World Patent Information Journal.
Related content
02 10 2024
< 1 minute
Certara Completes Acquisition of Chemaxon
The combined organization offers life sciences companies predictive biosimulation and scientific...
10 07 2024
< 1 minute
Certara to Acquire Chemaxon to Strengthen Drug Discovery Software Portfolio
We are excited to share the official announcement of Certara, our partner for over a decade, as...
13 12 2023
< 1 minute
Roadblocks of DMTA project success - and how to eliminate them
Discover how to navigate complex challenges in your DMTA projects - make informed compound...
20 11 2023
< 1 minute
"Make the company look like I won the lottery"
This article was originally published in Hungarian, in November 2023. Visit Publication Chemaxon...