Nadine Schneider
Nadine Schneider works in computational molecular science. Her shared research includes chemical-reaction fingerprints used as input to machine-learning models. Schneider studied bioinformatics at Saarland from April 2006 to December 2007. She had earlier studied bioinformatics at the bachelor’s level. She worked at Hamburg’s Centre for Bioinformatics from 2008 to 2014. Her BioScore research studied hydrogen-bond and dehydration energies in protein-ligand complexes. Schneider, Daniel Lowe, Roger Sayle and Gregory Landrum co-authored a paper on reaction fingerprints. Its abstract describes differences between product and reactant atom-pair fingerprints, agent properties and a 50-class machine-learning model for reaction-type classification.
- Now at
- Novartis
- Works
- 99
- Citations
- 2,441
- h-index
- 20
Publication numbers from OpenAlex, as of 14 October 2026.
Timeline
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2006–2007
Bioinformatics training
Schneider studied bioinformatics at Saarland from April 2006 to December 2007. She had earlier studied bioinformatics at the bachelor’s level.
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2008–2014
Algorithmic molecular design
She worked at Hamburg’s Centre for Bioinformatics from 2008 to 2014. Her BioScore research studied hydrogen-bond and dehydration energies in protein-ligand complexes.
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2015
Reaction fingerprints for machine learning
Schneider, Daniel Lowe, Roger Sayle and Gregory Landrum co-authored a paper on reaction fingerprints. Its abstract describes differences between product and reactant atom-pair fingerprints, agent properties and a 50-class machine-learning model for reaction-type classification.
Sources and credits
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