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List of works by David Schaller

Assessment of Flexible Shape Complementarity: New Opportunities to Explain and Induce Selectivity in Ligands of Protein Tyrosine Phosphatase 1B

scientific article published on 06 February 2019

Binding mechanism investigations guiding the synthesis of novel condensed 1,4-dihydropyridine derivatives with L-/T-type calcium channel blocking activity

scientific article published on 23 May 2018

Discovery of Michael acceptor containing 1,4-dihydropyridines as first covalent inhibitors of L-/T-type calcium channels

scientific article published on 07 August 2019

Ligand-guided homology modeling drives identification of novel histamine H3 receptor ligands

scientific article published on 25 June 2019

Next generation 3D pharmacophore modeling

scientific article published on 26 February 2020

PyRod: Tracing Water Molecules in Molecular Dynamics Simulations

scientific article published on 30 May 2019

Systematic Data Mining Reveals Synergistic H3R/MCHR1 Ligands.

scientific article

TeachOpenCADD 2022: open source and FAIR Python pipelines to assist in structural bioinformatics and cheminformatics research

scientific article published on 14 April 2022

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