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Journal of Computer-Aided Molecular Design
|
January 15, 2014
Prediction of free energies of hydration with COSMO-RS on the SAMPL4 data set
Jens Reinisch, Andreas Klamt
Journal of Computer-Aided Molecular Design
|
May 15, 2012
Prediction of free energies of hydration with COSMO-RS on the SAMPL3 data set
Jens Reinisch, Andreas Klamt, Michael Diedenhofen
Journal of Computer-Aided Molecular Design
|
June 14, 2021
COSMO-RS predictions of logP in the SAMPL7 blind challenge
Judith Warnau, Karin Wichmann, Jens Reinisch
Journal of Computer-Aided Molecular Design
|
November 28, 2019
COSMO-RS based predictions for the SAMPL6 logP challenge
Christoph Loschen, Jens Reinisch, Andreas Klamt
Journal of Computer-Aided Molecular Design
|
July 28, 2016
Prediction of cyclohexane-water distribution coefficients with COSMO-RS on the SAMPL5 data set
Andreas Klamt, Frank Eckert, Jens Reinisch, et al.
Journal of Chemical Information and Modeling
|
November 7, 2019
Benchmarking Different QM Levels for Usage with COSMO-RS
Jens Reinisch, Michael Diedenhofen, Rainer Wilcken, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2011
Polarization charge densities provide a predictive quantification of hydrogen bond energies
Andreas Klamt, Jens Reinisch, Frank Eckert, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 5, 2013
Interpretation of experimental hydrogen-bond enthalpies and entropies from COSMO polarisation charge densities
Andreas Klamt, Jens Reinisch, Frank Eckert, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
Journal of Computer-Aided Molecular Design
|
January 15, 2014
Prediction of free energies of hydration with COSMO-RS on the SAMPL4 data set
Jens Reinisch, Andreas Klamt
Journal of Computer-Aided Molecular Design
|
May 15, 2012
Prediction of free energies of hydration with COSMO-RS on the SAMPL3 data set
Jens Reinisch, Andreas Klamt, Michael Diedenhofen
Journal of Computer-Aided Molecular Design
|
June 14, 2021
COSMO-RS predictions of logP in the SAMPL7 blind challenge
Judith Warnau, Karin Wichmann, Jens Reinisch
Journal of Computer-Aided Molecular Design
|
November 28, 2019
COSMO-RS based predictions for the SAMPL6 logP challenge
Christoph Loschen, Jens Reinisch, Andreas Klamt
Journal of Computer-Aided Molecular Design
|
July 28, 2016
Prediction of cyclohexane-water distribution coefficients with COSMO-RS on the SAMPL5 data set
Andreas Klamt, Frank Eckert, Jens Reinisch, et al.
Journal of Chemical Information and Modeling
|
November 7, 2019
Benchmarking Different QM Levels for Usage with COSMO-RS
Jens Reinisch, Michael Diedenhofen, Rainer Wilcken, et al.
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2011
Polarization charge densities provide a predictive quantification of hydrogen bond energies
Andreas Klamt, Jens Reinisch, Frank Eckert, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 5, 2013
Interpretation of experimental hydrogen-bond enthalpies and entropies from COSMO polarisation charge densities
Andreas Klamt, Jens Reinisch, Frank Eckert, et al.
Page
of 1