Augmenting AI in Drug Discovery: How to Boost Workflow Performance (Workshop)

webinar

Thu, 27 Feb 2025, 16:00 CET (Berlin)

Dr. Alexander Neumann, BioSolveIT, Germany

Augmenting AI in Drug Discovery: How to Boost Workflow Performance (Workshop)

The experience of recent years has shown that a common theme emerges in the context of machine learning (ML) and artificial intelligence (AI): the more and broader data the better. To increase the precision of predictions, it is not only necessary to have more data points but also to incorporate additional layers of information to improve the performance of the models.

In this workshop, we aim to explore how to efficiently obtain new data points that open up new dimensions for generating actionable results. From transforming de novo-generated outcomes into readily accessible molecules to structure-based optimization of interactions, we will also place a strong emphasis on an often-overlooked aspect: economic feasibility in a holistic context.

In summary, achieving better and more cost-effective results — faster.

The discussion will be accompanied by published workflow implementations applying BioSolveIT technologies.

Participants can request a certificate of attendance upon successful completion of this workshop.

Current news

LifeCheMyriads by Life Chemicals - Access now with our tools
August 31, 2026 09:39 CEST
LifeCheMyriads brings an actionable, novelty-focused universe of 53 billion on-demand synthesizable compounds directly into your workflow. Created by Life Chemicals, this collection was built from 210 in-house-validated reaction protocols and 20,000+ proprietary and commercially available building blocks. The result is a medicinal chemistry-driven catalog spanning more than 340 million unique...
Read on
category
Challenge
Fall 2026 Scientific Challenge Deadline Approaching
August 11, 2026 09:15 CEST
We invite researchers in academia (students, postdocs, professors), non-profit organizations, and individuals to participate in our quarterly Scientific Challenge. Take advantage of our wide array of software to help meet your drug discovery goals. How to Participate Just send us a proposal for the project you would like to advance...
Read on
category
Software
Comparing the Performance of BioSolveIT and Alternative Technologies
August 4, 2026 09:21 CEST
Chemical Space Docking® (C-S-D) is designed for computationally efficient structure-based exploration of ultra-large Chemical Spaces. But how does it compare with other approaches? When searching ultra-large Chemical Spaces, computational efficiency and algorithmic strategies are crucial if trillions of compounds are to be screened for potential candidates. The approaches used to...
Read on