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Home Members Secker, Christopher, Dr.

Secker, Christopher, Dr.

Contact

Room
4034
Phone
+49 30 841 85 - 386
Email
Email
Division
Parallel and Distributed Computing
Department
Supercomputing
Group
Efficient Large Scale Computing in Life Sciences

Projects

Projects as Head

HPC and Machine Learning for Drug Discovery

HPC and ML for Drug Discovery

High-performance computers are required to simulate complex systems that allow to study the behavior of molecules under real conditions. This project combines artificial...

HPC and ML for Drug Discovery

Projects as Member

Pareto-ML-Optimization-Cycle

AA1-19 Drug Candidates as Pareto Optima in Chemical Space

The search for novel drug candidates that, at the same time, act with high efficacy, comply with defined chemical properties, and also show low off-target effects can be...

AA1-19 Drug Candidates as Pareto Optima in Chemical Space