Janez Mavri

Ljubljana, 1000, Slovenia

Last Updated: 09/26/2026

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Found 46 publications

l-DOPA-Containing Protein Autoxidation: An Empirical Valence Bond Simulation of the Rate-Limiting Step.

l-DOPA-Containing Protein Autoxidation: An Empirical Valence Bond Simulation of the Rate-Limiting Step.

Journal: The journal of physical chemistry. B

Published: November 24, 2025

Spatiotemporal dynamics of local anesthetic diffusion in nerve revealed by a 2D computational model.

Spatiotemporal dynamics of local anesthetic diffusion in nerve revealed by a 2D computational model.

Journal: Biophysical journal

Published: May 14, 2025

L-DOPA Autoxidation: An Empirical Valence Bond Simulation of the Reactive Step.

L-DOPA Autoxidation: An Empirical Valence Bond Simulation of the Reactive Step.

Journal: The journal of physical chemistry. B

Published: August 24, 2024

Computational Modeling and Characterization of Peptides Derived from Nanobody Complementary-Determining Region 2 (CDR2) Targeting Active-State Conformation of the β2-Adrenergic Receptor (β2AR).

Computational Modeling and Characterization of Peptides Derived from Nanobody Complementary-Determining Region 2 (CDR2) Targeting Active-State Conformation of the β2-Adrenergic Receptor (β2AR).

Journal: Biomolecules

Published: February 27, 2024

How Azide Ion/Hydrazoic Acid Passes Through Biological Membranes: An Experimental and Computational Study.

How Azide Ion/Hydrazoic Acid Passes Through Biological Membranes: An Experimental and Computational Study.

Journal: The protein journal

Published: May 18, 2023

Antioxidant activity of lidocaine, bupivacaine, and ropivacaine in aqueous and lipophilic environments: an experimental and computational study.

Antioxidant activity of lidocaine, bupivacaine, and ropivacaine in aqueous and lipophilic environments: an experimental and computational study.

Journal: Frontiers in chemistry

Published: April 19, 2023

Micro-pharmacokinetics of lidocaine and bupivacaine transfer across a myelinated nerve fiber.

Micro-pharmacokinetics of lidocaine and bupivacaine transfer across a myelinated nerve fiber.

Journal: Computers in biology and medicine

Published: April 14, 2023

Computational Insights into β-Carboline Inhibition of Monoamine Oxidase A.

Computational Insights into β-Carboline Inhibition of Monoamine Oxidase A.

Journal: Molecules (Basel, Switzerland)

Published: September 16, 2022

Brunner syndrome caused by point mutation explained by multiscale simulation of enzyme reaction.

Brunner syndrome caused by point mutation explained by multiscale simulation of enzyme reaction.

Journal: Scientific reports

Published: April 11, 2022

COVID-19 infection and neurodegeneration: Computational evidence for interactions between the SARS-CoV-2 spike protein and monoamine oxidase enzymes.

COVID-19 infection and neurodegeneration: Computational evidence for interactions between the SARS-CoV-2 spike protein and monoamine oxidase enzymes.

Journal: Computational and structural biotechnology journal

Published: January 07, 2022

Why Monoamine Oxidase B Preferably Metabolizes N-Methylhistamine over Histamine: Evidence from the Multiscale Simulation of the Rate-Limiting Step.

Why Monoamine Oxidase B Preferably Metabolizes N-Methylhistamine over Histamine: Evidence from the Multiscale Simulation of the Rate-Limiting Step.

Journal: International journal of molecular sciences

Published: January 04, 2022

An electrostatic duel: subtle differences in the catalytic performance of monoamine oxidase A and B isoenzymes elucidated at the residue level using quantum computations.

An electrostatic duel: subtle differences in the catalytic performance of monoamine oxidase A and B isoenzymes elucidated at the residue level using quantum computations.

Journal: Physical chemistry chemical physics : PCCP

Published: November 22, 2021

Showing 1-12 of 46

Last Updated: 09/26/2026