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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
|
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.
Journal of Computer-Aided Molecular Design
|
October 20, 2020
Quantum-mechanical property prediction of solvated drug molecules: what have we learned from a decade of SAMPL blind prediction challenges?
Nicolas Tielker, Lukas Eberlein, Gerhard Hessler, et al.
Angewandte Chemie (International Ed. in English)
|
June 21, 2021
Chemically Stabilized DNA Barcodes for DNA-Encoded Chemistry
Marco Potowski, Verena B K Kunig, Lukas Eberlein, et al.
Frontiers in Chemistry
|
June 27, 2022
Investigations Into Chemically Stabilized Four-Letter DNA for DNA-Encoded Chemistry
Marco Potowski, Verena B K Kunig, Lukas Eberlein, et al.
Angewandte Chemie (International Ed. in English)
|
October 8, 2024
Solvent-Controlled Separation of Integratively Self-Sorted Pd<sub>2</sub>L<sup>A</sup> <sub>2</sub>L<sup>B</sup> <sub>2</sub> Coordination Cages
Kristina E Ebbert, Fabian Sendzik, Laura Neukirch, et al.
Biophysical Chemistry
|
September 16, 2019
High pressure response of <sup>1</sup>H NMR chemical shifts of purine nucleotides
Claudia E Munte, Matthias Karl, Waldemar Kauter, et al.
Biophysical Chemistry
|
June 10, 2020
Erratum: High pressure response of <sup>1</sup>H NMR chemical shifts of purine nucleotides
Claudia E Munte, Matthias Karl, Waldemar Kauter, et al.
Journal of Chemical Theory and Computation
|
March 4, 2020
Tautomeric Equilibria of Nucleobases in the Hachimoji Expanded Genetic Alphabet
Lukas Eberlein, Frank R Beierlein, Nico J R van Eikema Hommes, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 11) with videos related to
Sort By:
Page
of 2
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
|
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.
Journal of Computer-Aided Molecular Design
|
October 20, 2020
Quantum-mechanical property prediction of solvated drug molecules: what have we learned from a decade of SAMPL blind prediction challenges?
Nicolas Tielker, Lukas Eberlein, Gerhard Hessler, et al.
Angewandte Chemie (International Ed. in English)
|
June 21, 2021
Chemically Stabilized DNA Barcodes for DNA-Encoded Chemistry
Marco Potowski, Verena B K Kunig, Lukas Eberlein, et al.
Frontiers in Chemistry
|
June 27, 2022
Investigations Into Chemically Stabilized Four-Letter DNA for DNA-Encoded Chemistry
Marco Potowski, Verena B K Kunig, Lukas Eberlein, et al.
Angewandte Chemie (International Ed. in English)
|
October 8, 2024
Solvent-Controlled Separation of Integratively Self-Sorted Pd<sub>2</sub>L<sup>A</sup> <sub>2</sub>L<sup>B</sup> <sub>2</sub> Coordination Cages
Kristina E Ebbert, Fabian Sendzik, Laura Neukirch, et al.
Biophysical Chemistry
|
September 16, 2019
High pressure response of <sup>1</sup>H NMR chemical shifts of purine nucleotides
Claudia E Munte, Matthias Karl, Waldemar Kauter, et al.
Biophysical Chemistry
|
June 10, 2020
Erratum: High pressure response of <sup>1</sup>H NMR chemical shifts of purine nucleotides
Claudia E Munte, Matthias Karl, Waldemar Kauter, et al.
Journal of Chemical Theory and Computation
|
March 4, 2020
Tautomeric Equilibria of Nucleobases in the Hachimoji Expanded Genetic Alphabet
Lukas Eberlein, Frank R Beierlein, Nico J R van Eikema Hommes, et al.
Page
of 2