Alexander Hagg

5PUBLICATIONS
8CO-AUTHORS
Biomolecular modelling and designComputational chemistryFormal methods for softwareAutomation and technology in building and constructionIntegrable systems (classical and quantum)
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Publications (5)

|Nov 09, 2026
Molecular function-guided unsupervised similarity-based enrichment for low-data virtual screening.

|Sep 05, 2025
Speed up Multi-Scale Force-Field Parameter Optimization by Substituting Molecular Dynamics Calculations with a Machine Learning Surrogate Model.

Robin Strickstrock, Alexander Hagg, Dirk Reith

|Jul 19, 2023
Open-Source Machine Learning in Computational Chemistry.

Alexander Hagg, Karl N Kirschner

|Apr 06, 2023
Efficient Quality Diversity Optimization of 3D Buildings through 2D Pre-Optimization.

Alexander Hagg, Martin L Kliemank, Alexander Asteroth

|Mar 21, 2023
Determining Lennard-Jones Parameters Using Multiscale Target Data through Presampling-Enhanced, Surrogate-Assisted Global Optimization.

Max Müller, Alexander Hagg, Robin Strickstrock

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Frequent Collaborators

3 joint publications

Karl N Kirschner

3 joint publications

Dirk Reith

2 joint publications

Robin Strickstrock

1 joint publications

Martin L Kliemank