Large collections of combinatorial libraries are an integral element in today’s pharmaceutical industry. There is a high interest to execute similarity and substructure searches against all virtual compounds that are synthetically accessible by any such library. Here we present a tool which facilitates searching in very large combinatorial libraries.
Cheminfo Stories 2021 Virtual UGM | Rule Based Search
Posted by
András Volford
on 13 11 2021
Related content
13 07 2022
< 1 minute
ICCS 2022 - Translating data to predictive models
Biological, chemical and physical properties of molecules are encoded in their molecular structure....
13 04 2022
< 1 minute
Efficient biomolecular structural data handling and analysis - Webinar with Discngine
Presenters: Peter Schmidtke- Product Manager, Discngine Márk Somogyi- Product Manager, Chemaxon...
13 12 2021
< 1 minute
Cheminfo Stories Virtual UGM 2021 Asia Pacific Edition: Deep dive in the future of chemical patent drafting and in-house IP management
Writing chemical patents with Markush claims is a time-consuming, complex and business-critical...
13 12 2021
< 1 minute
Cheminfo Stories 2021 Virtual UGM Asia Pacific Edition: Design of new compounds from the available chemical space
In computational compound design workflows, the analysis of the available chemical space is an...