Univ.-Prof. Dipl.-Chem. Dr. Christian Schröder
Christian Schröder
1 - 20 out of 100













Weiss, N., Thielemann, G., Nagel, K., Schmidt, C. H., Seifert, A., Kassner, L., Strehmel, V., Corzilius, B., Schroeder, C., & Spange, S. (2021). The influence of the cation structure on the basicity-related polarity of ionic liquids. Physical Chemistry Chemical Physics, 23(47), 26750-26760. https://doi.org/10.1039/d1cp03986e






Zeindlhofer, V., Hudson, P., Palvoelgyi, A. M., Welsch, M., Almarashi, M., Woodcock, H. L., Brooks, B., Bica-Schroeder, K., & Schroeder, C. (2020). Enantiomerization of Axially Chiral Biphenyls: Polarizable MD Simulations in Water and Butylmethylether. International Journal of Molecular Sciences, 21(17), 1-19. [6222]. https://doi.org/10.3390/ijms21176222

1 - 20 out of 100

Molecular Dynamics Simulations of Proton Transfer in Ionic Liquids

Márta Gödeny (Speaker), Florian Jörg (Contributor), Nora Kovacs (Contributor), Maximilian Kovar (Contributor), Marie Parteder (Contributor) & Christian Schröder (Contributor)

12 Sep 2024

Activity: Talks and presentationsTalk or oral contributionScience to Science


Decomposition, interpretation and prediction of various ionic liquid solvation parameters: Kamlet-Taft, Catalan and Reichardt's dye

Christian Schröder (Speaker)

22 Apr 2024

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizable MD Simulations including proton transfer of the M2 ion channel

Christian Schröder (Invited speaker)

9 Feb 2024

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizable MD Simulations including proton transfer of the M2 ion channel

Christian Schröder (Invited speaker)

8 Feb 2024

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizable MD Simulations including proton transfer of the M2 ion channel

Christian Schröder (Invited speaker)

5 Feb 2024

Activity: Talks and presentationsTalk or oral contributionScience to Science


Charge and Proton Transfer in polarizable molecular dynamics simulations of ionic liquids

Christian Schröder (Speaker)

21 Nov 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Charge and Proton Transfer in polarizable molecular dynamics simulations of ionic liquids

Christian Schröder (Speaker)

9 Jul 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Nuclear Overhauser spectroscopy in hyperpolarized water - chemical vs. magnetic exchange

Ludovica Martina Epasto (Speaker), Philipp Honegger (Contributor), Kateryna Che (Contributor), Fanny Kozak (Contributor), Florian Jörg (Contributor), Pavel Kaderavek (Contributor), Christian Schröder (Contributor) & Dennis Kurzbach (Contributor)

6 Jul 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Comparison of Computational IR Spectra of Ionic Liquids

Andras Szabadi (Speaker) & Christian Schröder (Contributor)

20 Jun 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Investigating the transport of Excess Protons in a Protic Ionic Liquid via Polarizable Molecular Dynamics using Protex

Márta Gödeny (Speaker) & Christian Schröder (Contributor)

20 Jun 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Nuclear Overhauser spectroscopy in hyperpolarized water - chemical vs. magnetic exchange

Ludovica Martina Epasto (Speaker), Philipp Honegger (Contributor), Kateryna Che (Contributor), Fanny Kozak (Contributor), Florian Jörg (Contributor), Pavel Kaderavek (Contributor), Christian Schröder (Contributor) & Dennis Kurzbach (Contributor)

2 May 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Nuclear Overhauser spectroscopy in hyperpolarized water - chemical vs. magnetic exchange

Ludovica Martina Epasto (Speaker), Philipp Honegger (Contributor), Kateryna Che (Contributor), Fanny Kozak (Contributor), Florian Jörg (Contributor), Christian Schröder (Contributor) & Dennis Kurzbach (Contributor)

2 May 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Charge and proton transfer in polarizable molecular dynamics simulations of ionic liquids

Christian Schröder (Speaker)

24 Apr 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Protex - a python utility for proton exchange in molecular dynamics simulations

Florian Jörg (Speaker) & Christian Schröder (Contributor)

24 Apr 2023

Activity: Talks and presentationsTalk or oral contributionScience to Science


Integrating Dissolution DNP Hyperpolarized computation to characterize complex systems

Dennis Kurzbach (Speaker), Ludovica Martina Epasto (Contributor), Kateryna Che (Contributor), Fanny Kozak (Contributor), Pavel Kadeřávek (Contributor), Philipp Honegger (Contributor) & Christian Schröder (Contributor)

10 Jul 2022

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizable proton transfer molecular dynamics simulations of 1- methylimidazolium acetate

Christian Schröder (Invited speaker)

19 Jun 2022

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computational NMR spectroscopy of ionic liquids: Fast-field cycling and Nuclear Overhauser effect

Christian Schröder (Speaker)

5 Jun 2022

Activity: Talks and presentationsTalk or oral contributionScience to Science


Temperature dependence of the structure and dynamics in ionic liquids

Christian Schröder (Invited speaker)

17 Dec 2021

Activity: Talks and presentationsTalk or oral contributionScience to Science


Electrostatic interactions in ionic liquids

Christian Schröder (Invited speaker)

16 Aug 2020

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability effects in ionic liquids

Christian Schröder (Invited speaker)

10 Jul 2020

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computational spectroscopy of ionic liquids

Christian Schröder (Invited speaker)

4 Nov 2019

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computing atomic polarizabilites in ground and excited state

Christian Schröder (Speaker)

17 Jul 2019

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computational solvation analysis of biomolecules in aqueous ionic liquid mixtures

Christian Schröder (Invited speaker)

27 Jun 2019

Activity: Talks and presentationsTalk or oral contributionScience to Science


How to predict physico-chemicel properties from MD simulations

Christian Schröder (Invited speaker)

4 Nov 2018

Activity: Talks and presentationsTalk or oral contributionScience to Science


How to predict physicochemical properties of ionic liquids from MD simulations

Christian Schröder (Speaker)

17 Apr 2018

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability effects in ionic liquids

Christian Schröder (Invited speaker)

20 Mar 2018

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability effects in ionic liquids

Christian Schröder (Invited speaker)

16 Mar 2018

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computational Spectroscopy

Christian Schröder (Invited speaker)

1 Dec 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


The birth of a micelle

Christian Schröder (Invited speaker)

30 Nov 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizable MD Simulation of Ionic Liquids

Christian Schröder (Speaker)

24 Oct 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computational spectroscopy of (polarizable) ionic liquids

Christian Schröder (Invited speaker)

6 Jul 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Computational solvation dynamics spectroscopy

Christian Schröder (Invited speaker)

21 Jun 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability effects in ionic liquids

Christian Schröder (Speaker)

5 May 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability effects in ionic liquids

Christian Schröder (Speaker)

7 Apr 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability effects in ionic liquids

Christian Schröder (Speaker)

30 Mar 2017

Activity: Talks and presentationsTalk or oral contributionScience to Science


Polarizability in ionic liquids

Christian Schröder (Speaker)

21 Feb 2017

Activity: Talks and presentationsTalk or oral contributionOther


Computational Solvation Dynamics Spectroscopy of Coumarin C153 and Oxyquinolines in various solvents

Christian Schröder (Invited speaker)

21 Sep 2016

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric Spectroscopy

Christian Schröder (Invited speaker)

20 Sep 2016

Activity: Talks and presentationsTalk or oral contributionOther


Water meets Ionic Liquids: from homogeneous Mixtures to micellar systems in MD Simulations

Christian Schröder (Invited speaker)

19 Jun 2016

Activity: Talks and presentationsTalk or oral contributionOther


Solvation in ionic liquids: From chromophores to proteins

Christian Schröder (Speaker)

18 Apr 2016

Activity: Talks and presentationsTalk or oral contributionOther


Ionic Liquids at Charged Biological processes

Christian Schröder (Invited speaker)

14 Apr 2016

Activity: Talks and presentationsTalk or oral contributionOther


Polarizability effects in ionic liquids

Christian Schröder (Invited speaker)

7 Sep 2015

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric spectroscopy of proteins in various solvents

Christian Schröder (Invited speaker)

14 Jul 2015

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric spectroscopy of proteins in various solvents

Christian Schröder (Invited speaker)

17 Jun 2015

Activity: Talks and presentationsTalk or oral contributionOther


Polarizability effects in ionic liquids

Christian Schröder (Invited speaker)

12 Nov 2014

Activity: Talks and presentationsTalk or oral contributionOther


MD Simulations of ionic liquids at biological (charged) interfaces

Christian Schröder (Invited speaker)

27 Aug 2014

Activity: Talks and presentationsTalk or oral contributionOther


Hydrated ionic liquids: electrolytes or mixtures of polar solvents

Christian Schröder (Speaker)

10 Jul 2014

Activity: Talks and presentationsTalk or oral contributionOther


Polarisability in ionic liquids

Christian Schröder (Invited speaker)

15 Jun 2014

Activity: Talks and presentationsTalk or oral contributionOther


Polarizable models of ionic liquids and their applications

Christian Schröder (Invited speaker)

4 Jun 2014

Activity: Talks and presentationsTalk or oral contributionOther


Polarisabilities in ionic liquids

Christian Schröder (Speaker)

21 Jul 2013

Activity: Talks and presentationsTalk or oral contributionOther


Polarisabilities in ionic liquids

Christian Schröder (Keynote speaker)

18 Jul 2013

Activity: Talks and presentationsTalk or oral contributionOther


Polarisabilities in ionic liquids

Christian Schröder (Keynote speaker)

19 Apr 2013

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric spectroscopy of polarizable ionic liquids

Christian Schröder (Invited speaker)

3 Sep 2012

Activity: Talks and presentationsTalk or oral contributionOther



Computational (dielectric) of polarizable ionic liquids (Habilitationsvortrag)

Christian Schröder (Speaker)

19 Mar 2012

Activity: Talks and presentationsTalk or oral contributionOther


Molecular dynamic simulation of polarizable Ionic liquids

Christian Schröder (Invited speaker)

14 Sep 2011

Activity: Talks and presentationsTalk or oral contributionOther


Molecular dynamics simulation of polarizable ionic liquids

Christian Schröder (Speaker)

22 Aug 2011

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric spectra of polarizable ionic liquids

Christian Schröder (Invited speaker)

1 Aug 2011

Activity: Talks and presentationsTalk or oral contributionOther


The influence of polarizabilities on the porperties of molecular ionic liquids : CHARMM-Meeting

Christian Schröder (Speaker)

13 Jul 2011

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric spectra of polarizable ionic liquids

Christian Schröder (Invited speaker)

23 Jun 2011

Activity: Talks and presentationsTalk or oral contributionOther


Computational dielectric spectra of polarizable ionic liquids

Christian Schröder (Speaker)

15 Jun 2011

Activity: Talks and presentationsTalk or oral contributionOther



Molecular dynamics simulations of molecular ionic liquids

Christian Schröder (Invited speaker)

13 Dec 2010

Activity: Talks and presentationsTalk or oral contributionOther


Molecular Dynamics simulations of molecular ionic liquids

Christian Schröder (Invited speaker)

16 Aug 2010

Activity: Talks and presentationsTalk or oral contributionOther


Molecular Dynamics Simulations of molecular ionic liquids

Christian Schröder (Keynote speaker)

16 Aug 2010

Activity: Talks and presentationsTalk or oral contributionOther


Dielectric properties of Neat Ionic Liquids of Mixtures of water and as solvent for Biomolecules

Christian Schröder (Speaker)

15 May 2010

Activity: Talks and presentationsTalk or oral contributionOther


On the collective network of ionic liquid/water mixtures

Christian Schröder (Speaker)

8 Jan 2009

Activity: Talks and presentationsTalk or oral contributionOther


On the collective network of ionic liquid/water mixtures

Christian Schröder (Speaker)

24 Nov 2008

Activity: Talks and presentationsTalk or oral contributionOther


On the collective network of ionic liquid/water mixtures

Christian Schröder (Speaker)

27 May 2008

Activity: Talks and presentationsTalk or oral contributionOther


parallel performance of molecular dynamics simulation

Christian Schröder (Speaker)

21 Jul 2007

Activity: Talks and presentationsTalk or oral contributionOther


3D Fast Fourier transform in Charmm II

Christian Schröder (Speaker)

21 Mar 2007

Activity: Talks and presentationsTalk or oral contributionOther


3D Fast Fourier transform in Charmm

Christian Schröder (Speaker)

8 Mar 2007

Activity: Talks and presentationsTalk or oral contributionOther


Enhancing trajectory production in molecular dynamics

Christian Schröder (Speaker)

16 Feb 2007

Activity: Talks and presentationsTalk or oral contributionOther


Proton transfer in protic ionic liquids

Schröder, C.

4/06/204/05/23

Project: Research funding


Ionenaggreg. von chir.ion.Flüss

Schröder, C.

1/01/1730/06/21

Project: Research funding


Simulationsanalyse zur Solventd

Schröder, C.

12/10/1511/10/18

Project: Research funding


SIDIS

Schröder, C.

1/04/1331/03/15

Project: Research funding


Department of Computational Biological Chemistry

Deputy Head
EDV-Beauftragter
Sicherheitsvertrauensperson

Währinger Straße 17
1090 Wien
Room: EG2/3

T: +43-1-4277-52711

christian.schroeder@univie.ac.at