Introduction to infiniSee 6 ‘Echo’: Completing the Trinity of Chemical Space Navigation


Thu, 28 Mar 2024, 16:00 CET (Berlin)

Dr. Alexander Neumann, BioSolveIT, Germany

Introduction to infiniSee 6 ‘Echo’: Completing the Trinity of Chemical Space Navigation

With the recent release of infiniSee 6 — code-name ‘Echo’ — BioSolveIT’s Chemical Space navigation platform receives its third search method to mine compounds of interest from ultra-large molecule collections. Drug discovery enthusiasts can now select between three modes to dive into Chemical Spaces: Scaffold Hopper, Analog Hunter, and Motif Matcher (respectively, using FTrees, SpaceLight and SpaceMACS algorithms under the hood).

In this webinar we will give an introduction to infiniSee as well as an overview on the different screening applications and their scientific background. Through practical examples we will illustrate various application scenarios and demonstrate how to effectively utilize the platform to overcome a range of challenges encountered in drug discovery projects. This includes ultra-fast SAR analysis, scaffold hopping, and augmented FBDD.

Novices and seasoned professionals alike shall find great value in this presentation.

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