A sequel for beginners, part 2: ligand-based drug design — the basics

webinar

Tue, 18 Feb 2014, 17:00 CET (Berlin)

A sequel for beginners, part 2: ligand-based drug design — the basics

“But we don’t have a protein structure!&quot – it’s a common complaint in drug hunting. In fact, you don’t have your back to the wall if you need to spot active compounds in this situation! In this BioSolveIT webinar, you will learn the background to basic techniques such as ligand superposition. By the end of the hour, you will have learned how the impossible becomes possible, intelligently mining for interesting and synthetically feasible leads from gigantically large spaces of potential compounds in just a few minutes.

Current news

WuXi’s GalaXi Space September 2025 – Expanded to 26 Billion Molecules!
September 17, 2025 10:03 CEST
The September 2025 update of WuXi LabNetwork’s GalaXi Space delivers a major expansion, now featuring over 25.8 billion synthesis-ready products. Built from 185 curated reactions and 30,877 high-quality building blocks, GalaXi is one of the largest tangible Chemical Spaces for modern drug discovery. This release broadens structural diversity with novel...
Read on
category
Events
Workshop in Boston: The Trillion Compound Workshop: BioSolveIT x Enamine featuring Molecular Glue Case Study
September 8, 2025 13:04 CEST
Joint Boston Workshop with Enamine: The Trillion Compound Workshop Register now Free to attend. Happy hour included. Seats are limited. In-Person Event. We invite all scientists, drug discovery enthusiasts, and interested professionals. Join BioSolveIT and Enamine in Boston for a co-organized workshop on efficient strategies for exploring Chemical Space. Learn...
Read on
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