Chemical Space Docking: Odyssey to Unlock Relevant Compounds

webinar

Thu, 26 Jan 2023, 16:00 CET (Berlin)

Dr. Serghei Glinca, CrystalsFirst and Alexander Neumann, BioSolveIT

Chemical Space Docking: Odyssey to Unlock Relevant Compounds

Chemical Space exploration is experiencing a major breakthrough, thanks to rapid advancements in the technology behind it. By seamlessly integrating computational and experimental methods, researchers are now able to unlock the full potential of structure-based drug discovery. One such method that has gained significant attention is Chemical Space Docking, which plays a vital role in identifying promising drug candidates and viable compounds among vast chemical space. This cutting-edge method offers a cost-efficient, rapid way to mine the most relevant compounds with a high hit rate and with chemical diversity among hits.[1],[2]

Join us as we explore the potential of make-on-demand Chemical Spaces and discover how this approach can retrieve relevant chemistry and lead to more effective drug development. Don’t miss out on this exciting opportunity to learn from experts in the field and unlock the secrets of Chemical Space.

You can access the webinar slides as well here (PDF).

Current news

Access the New Synple Space in 2D and 3D with BioSolveIT Technology
August 27, 2025 14:26 CEST
Now in your BioSolveIT toolkit: The Synple Space is officially accessible across BioSolveIT platforms and tools. Fast ligand-based screening: Multiple similarity search methods let you retrieve accessible compounds and assemble custom, project-specific libraries in moments. Local and secure: Searches complete in seconds to minutes on standard hardware—no cloud or third-party...
Read on
category
Events
Join us in Porto! Explore The Largest Compound Catalog with Enamine's REAL Space
August 27, 2025 11:11 CEST
Workshop in Porto: Exploring Chemical Space with BioSolveIT and Enamine Send mail to register Free to attend. Evening workshop with rooftop drinks. In-person event. We invite scientists, drug discovery professionals, and anyone interested in molecular design to an evening workshop in Porto, co-organized with Enamine. The session will show how...
Read on
category
Events
BioSolveIT Day 2025 — DrugSpace Symposium Finale (September 26)
August 25, 2025 13:44 CEST
Announcing BioSolveIT Day 2025 We are delighted to conclude the upcoming DrugSpace 2025 Symposium with a highlight on the latest developments from the BioSolveIT world. In four sessions, we will present our core platforms, discuss the latest BioSolveIT publication “A Benchmark Set of Bioactive Molecules for Diversity Analysis of Compound...
Read on