Fast force field-based optimization of protein-ligand complexes with graphics processor
Heinzerling, Lennart, Klein, Robert, Rarey, Matthias
Published in Journal of computational chemistry (15.12.2012)
Published in Journal of computational chemistry (15.12.2012)
Get full text
Journal Article
CONFECT: Conformations from an Expert Collection of Torsion Patterns
Schärfer, Christin, Schulz-Gasch, Tanja, Hert, Jérôme, Heinzerling, Lennart, Schulz, Benjamin, Inhester, Therese, Stahl, Martin, Rarey, Matthias
Published in ChemMedChem (01.10.2013)
Published in ChemMedChem (01.10.2013)
Get full text
Journal Article
Inside Cover: CONFECT: Conformations from an Expert Collection of Torsion Patterns (ChemMedChem 10/2013)
Schärfer, Christin, Schulz-Gasch, Tanja, Hert, Jérôme, Heinzerling, Lennart, Schulz, Benjamin, Inhester, Therese, Stahl, Martin, Rarey, Matthias
Published in ChemMedChem (01.10.2013)
Published in ChemMedChem (01.10.2013)
Get full text
Journal Article
Predicting Putative Inhibitors of 17β-HSD1
Heinzerling, Lennart, Hartmann, Rolf W., Frotscher , Martin, Neumann , Dirk
Published in Molecular informatics (11.10.2010)
Published in Molecular informatics (11.10.2010)
Get full text
Journal Article