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Journal of Computer-Aided Molecular Design
|
April 13, 2010
Blind prediction test of free energies of hydration with COSMO-RS
Andreas Klamt, Michael Diedenhofen
The Journal of Physical Chemistry. A
|
January 31, 2015
Calculation of solvation free energies with DCOSMO-RS
Andreas Klamt, Michael Diedenhofen
Journal of Chemical Information and Modeling
|
September 27, 2005
COSMOfrag: a novel tool for high-throughput ADME property prediction and similarity screening based on quantum chemistry
Martin Hornig, Andreas Klamt
Pharmaceutical Research
|
July 30, 2016
Computational Screening of Drug Solvates
Christoph Loschen, Andreas Klamt
Journal of Computational Chemistry
|
May 15, 2018
A refined cavity construction algorithm for the conductor-like screening model
Andreas Klamt, Michael Diedenhofen
Journal of Computer-Aided Molecular Design
|
April 9, 2010
Some conclusions regarding the predictions of tautomeric equilibria in solution based on the SAMPL2 challenge
Andreas Klamt, Michael Diedenhofen
Journal of Computational Chemistry
|
October 20, 2005
Accurate prediction of basicity in aqueous solution with COSMO-RS
Frank Eckert, Andreas Klamt
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
The Journal of Pharmacy and Pharmacology
|
April 9, 2015
Solubility prediction, solvate and cocrystal screening as tools for rational crystal engineering
Christoph Loschen, Andreas Klamt
Journal of Computer-Aided Molecular Design
|
November 28, 2019
COSMO-RS based predictions for the SAMPL6 logP challenge
Christoph Loschen, Jens Reinisch, Andreas Klamt
Page
of 5
Search research articles
Search
Showing results (1-10 of 41) with videos related to
Sort By:
Page
of 5
Journal of Computer-Aided Molecular Design
|
April 13, 2010
Blind prediction test of free energies of hydration with COSMO-RS
Andreas Klamt, Michael Diedenhofen
The Journal of Physical Chemistry. A
|
January 31, 2015
Calculation of solvation free energies with DCOSMO-RS
Andreas Klamt, Michael Diedenhofen
Journal of Chemical Information and Modeling
|
September 27, 2005
COSMOfrag: a novel tool for high-throughput ADME property prediction and similarity screening based on quantum chemistry
Martin Hornig, Andreas Klamt
Pharmaceutical Research
|
July 30, 2016
Computational Screening of Drug Solvates
Christoph Loschen, Andreas Klamt
Journal of Computational Chemistry
|
May 15, 2018
A refined cavity construction algorithm for the conductor-like screening model
Andreas Klamt, Michael Diedenhofen
Journal of Computer-Aided Molecular Design
|
April 9, 2010
Some conclusions regarding the predictions of tautomeric equilibria in solution based on the SAMPL2 challenge
Andreas Klamt, Michael Diedenhofen
Journal of Computational Chemistry
|
October 20, 2005
Accurate prediction of basicity in aqueous solution with COSMO-RS
Frank Eckert, Andreas Klamt
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
The Journal of Pharmacy and Pharmacology
|
April 9, 2015
Solubility prediction, solvate and cocrystal screening as tools for rational crystal engineering
Christoph Loschen, Andreas Klamt
Journal of Computer-Aided Molecular Design
|
November 28, 2019
COSMO-RS based predictions for the SAMPL6 logP challenge
Christoph Loschen, Jens Reinisch, Andreas Klamt
Page
of 5