Anders S. Christensen
- Operators in quantum machine learning: Response properties in chemical space
2019/02/12 by Anders S. Christensen, Felix A. Faber, O. Anatole von Lilienfeld · 33 citations
Materials Science · Computer Science · Chemistry · #Machine Learning in Materials Science #Quantum Computing Algorithms and Architecture #Advanced Physical and Chemical Molecular Interactions
- On the role of gradients for machine learning of molecular energies and\n forces
2020/07/19 by Anders S. Christensen, O. Anatole von Lilienfeld, Christensen, Anders S. +1 · 11 citations
Materials Science · Computer Science · Chemistry · #Machine Learning in Materials Science #Computational Drug Discovery Methods #Mass Spectrometry Techniques and Applications
- NeuralPLexer3: Accurate Biomolecular Complex Structure Prediction with Flow Models
2024/12/14 by Zhuoran Qiao, Feizhi Ding, Qiao, Zhuoran +22 · 6 citations
Biochemistry, Genetics and Molecular Biology · Computer Science · Decision Sciences · #Biomolecules (q-bio.BM) #Cell Image Analysis Techniques #Chemical Physics (physics.chem-ph) #FOS: Biological sciences #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Scientific Computing and Data Management #Statistical and Computational Modeling