Matthias Stein

ResearcherID Scopus Author ID Loop profile ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 38

Top Venues

Biochemistry

Dalton transactions (Cambridge, England : 2003)

Physical chemistry chemical physics : PCCP

RSC advances

Max-Planck-Gesellschaft

University of Manchester (MSC)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Max-Planck-Gesellschaft Jul 01 2010

Germany

Associate Professor :: Molecular Simulations and Design Group

Education History

University of Manchester

United Kingdom

MSC :: Chemistry

Publications

Froze Jameel, Matthias Stein
Chemical accuracy for ligand-receptor binding Gibbs energies through multi-level SQM/QM calculations. Physical chemistry chemical physics : PCCP (2024)
Vico Tenberg, Masoud Sadeghi, Axel Schultheis, Meenakshi Joshi, Matthias Stein, Heike Lorenz
Aqueous solution and solid-state behaviour of l-homophenylalanine: experiment, modelling, and DFT calculations. RSC advances 14 (15) (2024)
Yılmaz Özkılıç, Matthias Stein
Modelling the elusive conformational activation in kynurenine 3-monooxygenase. Organic & biomolecular chemistry (2024)
Froze Jameel, Matthias Stein
Chemical accuracy for ligand-receptor binding Gibbs energies through multi-level SQM/QM calculations. Physical chemistry chemical physics : PCCP 26 (31) (2024)
Froze Jameel, Matthias Stein
Chemical accuracy for ligand-receptor binding Gibbs energies through multi-level SQM/QM calculations. Physical chemistry chemical physics : PCCP 26 (31) (2024)
Froze Jameel, Matthias Stein
Chemical accuracy for ligand-receptor binding Gibbs energies through multi-level SQM/QM calculations. Physical chemistry chemical physics : PCCP 26 (31) (2024)
Yılmaz Özkılıç, Matthias Stein
Modelling the elusive conformational activation in kynurenine 3-monooxygenase. Organic & biomolecular chemistry 22 (32) (2024)
Vico Tenberg, Masoud Sadeghi, Axel Schultheis, Meenakshi Joshi, Matthias Stein, Heike Lorenz
Aqueous solution and solid-state behaviour of l-homophenylalanine: experiment, modelling, and DFT calculations. RSC advances 14 (15) (2024)
Jannis Barrera, Haleh H Haeri, Julian Heinrich, Matthias Stein, Dariush Hinderberger, Nora Kulak
Impact of N-heteroaromatic N-termini in Cu(II) ATCUN metallopeptides on their biorelevant redox activity. Dalton transactions (Cambridge, England : 2003) (2023)
Robert Creutznacher, Eric Schulze-Niemand, Patrick König, Vesna Stanojlovic, Alvaro Mallagaray, Thomas Peters, Matthias Stein, Mario Schubert
Conformational Control of Fast Asparagine Deamidation in a Norovirus Capsid Protein. Biochemistry 62 (5) (2023)
Robert Creutznacher, Eric Schulze-Niemand, Patrick König, Vesna Stanojlovic, Alvaro Mallagaray, Thomas Peters, Matthias Stein, Mario Schubert
Conformational Control of Fast Asparagine Deamidation in a Norovirus Capsid Protein. Biochemistry (2023)
Robert Creutznacher, Eric Schulze-Niemand, Patrick König, Vesna Stanojlovic, Alvaro Mallagaray, Thomas Peters, Matthias Stein, Mario Schubert
Conformational Control of Fast Asparagine Deamidation in a Norovirus Capsid Protein. Biochemistry 62 (5) (2023)
Jannis Barrera, Haleh H Haeri, Julian Heinrich, Matthias Stein, Dariush Hinderberger, Nora Kulak
Impact of N-heteroaromatic N-termini in Cu(II) ATCUN metallopeptides on their biorelevant redox activity. Dalton transactions (Cambridge, England : 2003) 52 (11) (2023)
Jannis Barrera, Haleh H Haeri, Julian Heinrich, Matthias Stein, Dariush Hinderberger, Nora Kulak
Impact of N-heteroaromatic N-termini in Cu(II) ATCUN metallopeptides on their biorelevant redox activity. Dalton transactions (Cambridge, England : 2003) 52 (11) (2023)
Robert Creutznacher, Eric Schulze-Niemand, Patrick König, Vesna Stanojlovic, Alvaro Mallagaray, Thomas Peters, Matthias Stein, Mario Schubert
Conformational Control of Fast Asparagine Deamidation in a Norovirus Capsid Protein. Biochemistry 62 (5) (2023)
Ravi Kumar, Matthias Stein
The Fully Oxidized State of the Glutamate Coordinated O 2 -Tolerant [NiFe]-Hydrogenase Shows a Ni(III)/Fe(III) Open-Shell Singlet Ground State. Journal of the American Chemical Society (2023)
Martynas Gavutis, Eric Schulze-Niemand, Hung-Hsun Lee, Bo Liedberg, Matthias Stein, Ramūnas Valiokas
Bilayer lipid membrane formation on surface assemblies with sparsely distributed tethers. Nanoscale (2023)
Jan-Christian Raabe, Froze Jameel, Matthias Stein, Jakob Albert, Maximilian J Poller
Heteroelements in polyoxometalates: a study on the influence of different group 15 elements on polyoxometalate formation. Dalton transactions (Cambridge, England : 2003) (2023)
Metehan Ilter, Eric Schulze-Niemand, Michael Naumann, Matthias Stein
Structural Dynamics of Lys11-Selective Deubiquitinylase Cezanne-1 during the Catalytic Cycle. Journal of chemical information and modeling (2023)
Robert Creutznacher, Eric Schulze-Niemand, Patrick König, Vesna Stanojlovic, Alvaro Mallagaray, Thomas Peters, Matthias Stein, Mario Schubert
Conformational Control of Fast Asparagine Deamidation in a Norovirus Capsid Protein. Biochemistry 62 (5) (2023)
Mookan Natarajan, Naveen Kumar, Meenakshi Joshi, Matthias Stein, Sandeep Kaur-Ghumaan
Mechanism of Diiron Hydrogenase Complexes Controlled by Nature of Bridging Dithiolate Ligand. ChemistryOpen 11 (1) (2022)
José Eduardo Zamudio Díaz Mirón, Matthias Stein
A benchmark for non-covalent interactions in organometallic crystals. Physical chemistry chemical physics : PCCP (2022)
Eric Schulze-Niemand, Michael Naumann, Matthias Stein
Substrate-assisted activation and selectivity of the bacterial RavD effector deubiquitinylase. Proteins (2021)
Dakshinamurthy Sivakumar, Matthias Stein
Binding of SARS-CoV Covalent Non-Covalent Inhibitors to the SARS-CoV-2 Papain-Like Protease and Ovarian Tumor Domain Deubiquitinases. Biomolecules 11 (6) (2021)
Esra Boz, Matthias Stein
Accurate Receptor-Ligand Binding Free Energies from Fast QM Conformational Chemical Space Sampling. International journal of molecular sciences 22 (6) (2021)
Julian Heinrich, Karolina Bossak-Ahmad, Mie Riisom, Haleh H Haeri, Tasha R Steel, Vinja Hergl, Alexander Langhans, Corinna Schattschneider, Jannis Barrera, Stephen M F Jamieson, Matthias Stein, Dariush Hinderberger, Christian G Hartinger, Wojciech Bal, Nora Kulak
Incorporation of β-Alanine in Cu(II) ATCUN Peptide Complexes Increases ROS Levels, DNA Cleavage and Antiproliferative Activity*. Chemistry (Weinheim an der Bergstrasse, Germany) (2021)
Dakshinamurthy Sivakumar, Vikash Kumar, Michael Naumann, Matthias Stein
Activation and selectivity of OTUB-1 and OTUB-2 deubiquitinylases. The Journal of biological chemistry 295 (20) (2020)
Eileen Münzberg, Matthias Stein
Structure and Dynamics of Mono- vs. Doubly Lipidated Rab5 in Membranes. International journal of molecular sciences 20 (19) (2019)
Alexander Petrenko, Matthias Stein
Toward a Molecular Reorganization Energy-Based Analysis of Third-Order Nonlinear Optical Properties of Polymethine Dyes and J-Aggregates. The journal of physical chemistry. A 123 (43) (2019)
Ramin Ekhteiari Salmas, Philip Seeman, Matthias Stein, Serdar Durdagi
Structural Investigation of the Dopamine-2 Receptor Agonist Bromocriptine Binding to Dimeric D2HighR and D2LowR States. Journal of chemical information and modeling 58 (4) (2018)
Indresh Kumar Pandey, Mookan Natarajan, Hemlata Faujdar, Firasat Hussain, Matthias Stein, Sandeep Kaur-Ghumaan
Intramolecular stabilization of a catalytic [FeFe]-hydrogenase mimic investigated by experiment and theory. Dalton transactions (Cambridge, England : 2003) 47 (14) (2018)
Hannes Konrad Buchholz, Matthias Stein
Accurate lattice energies of organic molecular crystals from periodic turbomole calculations. Journal of computational chemistry 39 (19) (2018)
Sergey M Melnikov, Matthias Stein
Molecular Dynamics Study of the Solution Structure, Clustering, and Diffusion of Four Aqueous Alkanolamines. The journal of physical chemistry. B 122 (10) (2018)
Eric Schulze, Matthias Stein
Simulation of Mixed Self-Assembled Monolayers on Gold: Effect of Terminal Alkyl Anchor Chain and Monolayer Composition. The journal of physical chemistry. B 122 (31) (2018)
Esra Boz, Nurcan Şenyurt Tuzun, Matthias Stein
Computational investigation of the control of the thermodynamics and microkinetics of the reductive amination reaction by solvent coordination and a co-catalyst. RSC advances 8 (64) (2018)
Eileen Edler, Matthias Stein
Recognition and stabilization of geranylgeranylated human Rab5 by the GDP Dissociation Inhibitor (GDI). Small GTPases 10 (3) (2017)
Ramin Ekhteiari Salmas, Philip Seeman, Busecan Aksoydan, Ismail Erol, Isik Kantarcioglu, Matthias Stein, Mine Yurtsever, Serdar Durdagi
Analysis of the Glutamate Agonist LY404,039 Binding to Nonstatic Dopamine Receptor D2 Dimer Structures and Consensus Docking. ACS chemical neuroscience 8 (6) (2017)
Ramin Ekhteiari Salmas, Yusuf Serhat Is, Serdar Durdagi, Matthias Stein, Mine Yurtsever
A QM protein-ligand investigation of antipsychotic drugs with the dopamine D2 Receptor (D2R). Journal of biomolecular structure & dynamics 36 (10) (2017)

Matthias Stein.css-eqlu8i{font-size:small;padding-left:4px;}

Publication Activity (10 Years)

Top Topics

Top Venues

Matthias Stein