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Charge Spreading in Deep Eutectic Solvents

Chemphyschem, 2016-11, Vol.17 (21), p.3354-3358

2016

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Structure and dynamics of the protic ionic liquid monomethylammonium nitrate ( [ CH 3 NH 3 ] [ NO 3 ] ) from ab initio molecular dynamics simulations

The Journal of chemical physics, 2010-03, Vol.132 (12), p.124506-124506-13

2010

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Assessment of Kohn―Sham density functional theory and Moller―Plesset perturbation theory for ionic liquids

Physical chemistry chemical physics : PCCP, 2013-08, Vol.15 (32), p.13664-13675

2013

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Deep eutectic solvents: similia similibus solvuntur?

Physical chemistry chemical physics : PCCP, 2017-02, Vol.19 (5), p.4041-4047

Zahn, Stefan

2017

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Intermolecular Forces in an Ionic Liquid ([Mmim][Cl]) versus Those in a Typical Salt (NaCl)

Angewandte Chemie (International ed.), 2008-04, Vol.47 (19), p.3639-3641

2008

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Depolarization of water in protic ionic liquids

Physical chemistry chemical physics : PCCP, 2011-01, Vol.13 (33), p.15083-15093

2011

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Efficient Molecular Dynamics Simulations of Deep Eutectic Solvents with First-Principles Accuracy Using Machine Learning Interatomic Potentials

Journal of chemical theory and computation, 2023-12, Vol.19 (23), p.8732-8742

2023

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Cobalt Boryl Complexes: Enabling and Exploiting Migratory Insertion in Base-Metal-Mediated Borylation

Angewandte Chemie (International ed.), 2015-08, Vol.54 (33), p.9586-9590

International ed. in English, 2015

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Reversible Optical Switching of Polyoxovanadates and Their Communication via Photoexcited States

Advanced science, 2024-08, Vol.11 (30), p.e2401595-n/a

2024

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Molecular Features of Reline and Homologous Deep Eutectic Solvents Contributing to Nonideal Mixing Behavior

The journal of physical chemistry. B, 2020-09, Vol.124 (35), p.7586-7597

2020

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Ion Correlation in Choline Chloride–Urea Deep Eutectic Solvent (Reline) from Polarizable Molecular Dynamics Simulations

The journal of physical chemistry. B, 2022-05, Vol.126 (18), p.3439-3449

2022

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Locality and Fluctuations: Trends in Imidazolium-Based Ionic Liquids and Beyond

Journal of chemical theory and computation, 2011-10, Vol.7 (10), p.3040-3044

2011

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Radiation-Induced Graft Immobilization (RIGI): Covalent Binding of Non-Vinyl Compounds on Polymer Membranes

Polymers, 2021-06, Vol.13 (11), p.1849

2021

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Immobilization of Bi2WO6 on Polymer Membranes for Photocatalytic Removal of Micropollutants from Water – A Stable and Visible Light Active Alternative

Global challenges, 2024-03, Vol.8 (3), p.2300198-n/a

2024

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A Way to Stable, Highly Emissive Fluorubine Dyes: Tuning the Electronic Properties of Azaderivatives of Pentacene by Introducing Substituted Pyrazines

Chemistry : a European journal, 2012-04, Vol.18 (15), p.4549-4557

2012

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Hydrophilic Ionic Liquid Mixtures of Weakly and Strongly Coordinating Anions with and without Water

ACS omega, 2018-08, Vol.3 (8), p.8567-8582

2018

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Understanding ionic liquids from theoretical methods

Journal of molecular liquids, 2014-04, Vol.192, p.71-76

2014

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Nitrile-Functionalized Pyridinium, Pyrrolidinium, and Piperidinium Ionic Liquids

The journal of physical chemistry. B, 2011-07, Vol.115 (26), p.8424-8438

2011

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Addressing Methionine in Molecular Design through Directed Sulfur–Halogen Bonds

Journal of chemical theory and computation, 2011-07, Vol.7 (7), p.2307-2315

2011

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Deep eutectic solvents: similia similibus solvuntur?Electronic supplementary information (ESI) available: The cluster displacement function of a classical molecular dynamics simulation and the NCh-C-C-OCh dihedral angle distribution of choline. See DOI: 10.1039/c6cp08017k

Zahn, Stefan

2017-02

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Antibody-mediated targeting of the Orai1 calcium channel inhibits T cell function

PloS one, 2013-12, Vol.8 (12), p.e82944-e82944

2013

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Towards Allosteric Receptors: Adjustment of the Rotation Barrier of 2,2′-Bipyridine Derivatives

Chemistry : a European journal, 2009-03, Vol.15 (11), p.2572-2580

2009

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Structure and transport properties of LiTFSI-based deep eutectic electrolytes from machine-learned interatomic potential simulations

The Journal of chemical physics, 2024-10, Vol.161 (13)

2024

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Characterization of Alternatively Spliced Transcript Variants of CLEC2D Gene

The Journal of biological chemistry, 2010-11, Vol.285 (46), p.36207-36215

2010

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Antifibrotic effects of a tissue inhibitor of metalloproteinase‐1 antibody on established liver fibrosis in rats

Hepatology (Baltimore, Md.), 2004-11, Vol.40 (5), p.1106-1115

2004

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Charge Spreading in Deep Eutectic Solvents

Structure and dynamics of the protic ionic liquid monomethylammonium nitrate ( [ CH 3 NH 3 ] [ NO 3 ] ) from ab initio molecular dynamics simulations

Assessment of Kohn―Sham density functional theory and Moller―Plesset perturbation theory for ionic liquids

Deep eutectic solvents: similia similibus solvuntur?

Intermolecular Forces in an Ionic Liquid ([Mmim][Cl]) versus Those in a Typical Salt (NaCl)

Depolarization of water in protic ionic liquids

Efficient Molecular Dynamics Simulations of Deep Eutectic Solvents with First-Principles Accuracy Using Machine Learning Interatomic Potentials

Cobalt Boryl Complexes: Enabling and Exploiting Migratory Insertion in Base-Metal-Mediated Borylation

Reversible Optical Switching of Polyoxovanadates and Their Communication via Photoexcited States

Molecular Features of Reline and Homologous Deep Eutectic Solvents Contributing to Nonideal Mixing Behavior

Ion Correlation in Choline Chloride–Urea Deep Eutectic Solvent (Reline) from Polarizable Molecular Dynamics Simulations

Locality and Fluctuations: Trends in Imidazolium-Based Ionic Liquids and Beyond

Radiation-Induced Graft Immobilization (RIGI): Covalent Binding of Non-Vinyl Compounds on Polymer Membranes

Immobilization of Bi2WO6 on Polymer Membranes for Photocatalytic Removal of Micropollutants from Water – A Stable and Visible Light Active Alternative

A Way to Stable, Highly Emissive Fluorubine Dyes: Tuning the Electronic Properties of Azaderivatives of Pentacene by Introducing Substituted Pyrazines

Hydrophilic Ionic Liquid Mixtures of Weakly and Strongly Coordinating Anions with and without Water

Understanding ionic liquids from theoretical methods

Nitrile-Functionalized Pyridinium, Pyrrolidinium, and Piperidinium Ionic Liquids

Addressing Methionine in Molecular Design through Directed Sulfur–Halogen Bonds

Deep eutectic solvents: similia similibus solvuntur?Electronic supplementary information (ESI) available: The cluster displacement function of a classical molecular dynamics simulation and the NCh-C-C-OCh dihedral angle distribution of choline. See DOI: 10.1039/c6cp08017k

Antibody-mediated targeting of the Orai1 calcium channel inhibits T cell function

Towards Allosteric Receptors: Adjustment of the Rotation Barrier of 2,2′-Bipyridine Derivatives

Structure and transport properties of LiTFSI-based deep eutectic electrolytes from machine-learned interatomic potential simulations

Characterization of Alternatively Spliced Transcript Variants of CLEC2D Gene

Antifibrotic effects of a tissue inhibitor of metalloproteinase‐1 antibody on established liver fibrosis in rats

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