Leonid Komissarov

Publication Activity (10 Years)

Years Active: 2021-2024
Publications (10 Years): 12

Top Topics

Single Molecule

Sentinel Lymph Node

Molecular Dynamics

Top Venues

Journal of the American Chemical Society

Chemphyschem : a European journal of chemical physics and physical chemistry

Molecular pharmaceutics

Journal of chemical information and modeling

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

Publications

Leonid Komissarov, Nenad Manevski, Katrin Groebke Zbinden, Torsten Schindler, Marinka Zitnik, Lisa Sach-Peltason
Actionable Predictions of Human Pharmacokinetics at the Drug Design Stage. Molecular pharmaceutics (2024)
Leonid Komissarov, Nenad Manevski, Katrin Groebke Zbinden, Torsten Schindler, Marinka Zitnik, Lisa Sach-Peltason
Actionable Predictions of Human Pharmacokinetics at the Drug Design Stage. Molecular pharmaceutics 21 (9) (2024)
Lukas Zeisel, Jan G Felber, Karoline C Scholzen, Carina Schmitt, Alexander J Wiegand, Leonid Komissarov, Elias S J Arnér, Oliver Thorn-Seshold
Piperazine-Fused Cyclic Disulfides Unlock High-Performance Bioreductive Probes of Thioredoxins and Bifunctional Reagents for Thiol Redox Biology. Journal of the American Chemical Society 146 (8) (2024)
Lukas Zeisel, Jan G Felber, Karoline C Scholzen, Carina Schmitt, Alexander J Wiegand, Leonid Komissarov, Elias S J Arnér, Oliver Thorn-Seshold
Piperazine-Fused Cyclic Disulfides Unlock High-Performance Bioreductive Probes of Thioredoxins and Bifunctional Reagents for Thiol Redox Biology. Journal of the American Chemical Society 146 (8) (2024)
Lukas Zeisel, Jan G Felber, Karoline C Scholzen, Carina Schmitt, Alexander J Wiegand, Leonid Komissarov, Elias S J Arnér, Oliver Thorn-Seshold
Piperazine-Fused Cyclic Disulfides Unlock High-Performance Bioreductive Probes of Thioredoxins and Bifunctional Reagents for Thiol Redox Biology. Journal of the American Chemical Society 146 (8) (2024)
Lukas Zeisel, Jan G Felber, Karoline C Scholzen, Carina Schmitt, Alexander J Wiegand, Leonid Komissarov, Elias S J Arnér, Oliver Thorn-Seshold
Piperazine-Fused Cyclic Disulfides Unlock High-Performance Bioreductive Probes of Thioredoxins and Bifunctional Reagents for Thiol Redox Biology. Journal of the American Chemical Society (2024)
Lukas Krep, Felix Schmalz, Florian Solbach, Leonid Komissarov, Thomas Nevolianis, Wassja A Kopp, Toon Verstraelen, Kai Leonhard
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes. Chemphyschem : a European journal of chemical physics and physical chemistry 24 (7) (2023)
Leonid Komissarov, Lukas Krep, Felix Schmalz, Wassja A Kopp, Kai Leonhard, Toon Verstraelen
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part I: Force Field Development. Chemphyschem : a European journal of chemical physics and physical chemistry (2022)
Lukas Krep, Felix Schmalz, Florian Solbach, Leonid Komissarov, Thomas Nevolianis, Wassja A Kopp, Toon Verstraelen, Kai Leonhard
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes. Chemphyschem : a European journal of chemical physics and physical chemistry (2022)
Leonid Komissarov, Toon Verstraelen
Zeo-1, a computational data set of zeolite structures. Scientific data 9 (1) (2022)
Leonid Komissarov, Robert Rüger, Matti Hellström, Toon Verstraelen
ParAMS: Parameter Optimization for Atomistic and Molecular Simulations. Journal of chemical information and modeling 61 (8) (2021)
Leonid Komissarov, Toon Verstraelen
Improving the Silicon Interactions of GFN-xTB. Journal of chemical information and modeling (2021)