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ORCIDKarl-Heinz Baringhaus
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2010 – 2019
- 2017
[j5]Ido Y. Ben-Shalom
, Stefania Pfeiffer-Marek, Karl-Heinz Baringhaus, Holger Gohlke:
Efficient Approximation of Ligand Rotational and Translational Entropy Changes upon Binding for Use in MM-PBSA Calculations. J. Chem. Inf. Model. 57(2): 170-189 (2017)- 2014
- [j4]Jens Kunze, Nickolay Todoroff, Petra Schneider, Tiago Rodrigues, Tim Geppert, Felix Reisen, Herman Schreuder, Joachim Saas, Gerhard Hessler, Karl-Heinz Baringhaus, Gisbert Schneider:
Targeting Dynamic Pockets of HIV-1 Protease by Structure-Based Computational Screening for Allosteric Inhibitors. J. Chem. Inf. Model. 54(3): 987-991 (2014) - 2012
- [j3]Alexander Metz, Christopher Pfleger, Hannes Kopitz, Stefania Pfeiffer-Marek, Karl-Heinz Baringhaus, Holger Gohlke:
Hot Spots and Transient Pockets: Predicting the Determinants of Small-Molecule Binding to a Protein-Protein Interface. J. Chem. Inf. Model. 52(1): 120-133 (2012) - 2011
- [j2]K. Friedemann Schmidt, Andreas Evers, Alexander Amberg, Gerhard Hessler, Catherine Robles, Karl-Heinz Baringhaus:
Phototoxicity - from molecular descriptors to classification models. J. Cheminformatics 3(S-1): 10 (2011) - 2010
- [j1]Karl-Heinz Baringhaus, Gerhard Hessler, Thomas Klabunde:
Current aspects and future trends of computer-aided rescaffolding. J. Cheminformatics 2(S-1): 19 (2010)
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