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Bioorganic & Medicinal Chemistry Letters
|
June 9, 2018
Characterizing hydration sites in protein-ligand complexes towards the design of novel ligands
Hans Matter, Stefan Güssregen
Methods in Molecular Biology (Clifton, N.J.)
|
October 3, 2002
Approaches to library design for combinatorial chemistry
Stefan Güssregen, Bernd Wendt, Mark Warne
Journal of Computer-Aided Molecular Design
|
July 19, 2021
SAMPL7 physical property prediction from EC-RISM theory
Nicolas Tielker, Stefan Güssregen, Stefan M Kast
Nature Communications
|
March 7, 2026
Radiolabeling of oligopeptides by selective hydrogen isotope exchange with deuterium and tritium in aqueous buffers
Elisa Martinelli, Remo Weck, Stefan Güssregen, et al.
Journal of Computer-Aided Molecular Design
|
August 4, 2018
The SAMPL6 challenge on predicting aqueous pK<sub>a</sub> values from EC-RISM theory
Nicolas Tielker, Lukas Eberlein, Stefan Güssregen, et al.
Journal of Computer-Aided Molecular Design
|
March 31, 2010
Prediction of tautomer ratios by embedded-cluster integral equation theory
Stefan M Kast, Jochen Heil, Stefan Güssregen, et al.
Angewandte Chemie (International Ed. in English)
|
April 26, 2018
Highly Selective Directed Iridium-Catalyzed Hydrogen Isotope Exchange Reactions of Aliphatic Amides
Mégane Valero, Remo Weck, Stefan Güssregen, et al.
Journal of Cheminformatics
|
April 26, 2014
Quantum-mechanics-based molecular interaction fields for 3D-QSAR
Ahmed Elkerdawy, Stefan Güssregen, Hans Matter, et al.
Journal of Computer-Aided Molecular Design
|
January 26, 2020
The SAMPL6 challenge on predicting octanol-water partition coefficients from EC-RISM theory
Nicolas Tielker, Daniel Tomazic, Lukas Eberlein, et al.
Journal of Molecular Modeling
|
May 2, 2019
pK<sub>a</sub> calculations for tautomerizable and conformationally flexible molecules: partition function vs. state transition approach
Nicolas Tielker, Lukas Eberlein, Christian Chodun, et al.
Page
of 4
Search research articles
Search
Showing results (1-10 of 31) with videos related to
Sort By:
Page
of 4
Bioorganic & Medicinal Chemistry Letters
|
June 9, 2018
Characterizing hydration sites in protein-ligand complexes towards the design of novel ligands
Hans Matter, Stefan Güssregen
Methods in Molecular Biology (Clifton, N.J.)
|
October 3, 2002
Approaches to library design for combinatorial chemistry
Stefan Güssregen, Bernd Wendt, Mark Warne
Journal of Computer-Aided Molecular Design
|
July 19, 2021
SAMPL7 physical property prediction from EC-RISM theory
Nicolas Tielker, Stefan Güssregen, Stefan M Kast
Nature Communications
|
March 7, 2026
Radiolabeling of oligopeptides by selective hydrogen isotope exchange with deuterium and tritium in aqueous buffers
Elisa Martinelli, Remo Weck, Stefan Güssregen, et al.
Journal of Computer-Aided Molecular Design
|
August 4, 2018
The SAMPL6 challenge on predicting aqueous pK<sub>a</sub> values from EC-RISM theory
Nicolas Tielker, Lukas Eberlein, Stefan Güssregen, et al.
Journal of Computer-Aided Molecular Design
|
March 31, 2010
Prediction of tautomer ratios by embedded-cluster integral equation theory
Stefan M Kast, Jochen Heil, Stefan Güssregen, et al.
Angewandte Chemie (International Ed. in English)
|
April 26, 2018
Highly Selective Directed Iridium-Catalyzed Hydrogen Isotope Exchange Reactions of Aliphatic Amides
Mégane Valero, Remo Weck, Stefan Güssregen, et al.
Journal of Cheminformatics
|
April 26, 2014
Quantum-mechanics-based molecular interaction fields for 3D-QSAR
Ahmed Elkerdawy, Stefan Güssregen, Hans Matter, et al.
Journal of Computer-Aided Molecular Design
|
January 26, 2020
The SAMPL6 challenge on predicting octanol-water partition coefficients from EC-RISM theory
Nicolas Tielker, Daniel Tomazic, Lukas Eberlein, et al.
Journal of Molecular Modeling
|
May 2, 2019
pK<sub>a</sub> calculations for tautomerizable and conformationally flexible molecules: partition function vs. state transition approach
Nicolas Tielker, Lukas Eberlein, Christian Chodun, et al.
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of 4