Search research articles
Contact Us
Filters
Showing results (1-10 of 7) with videos related to
Page
of 1
Sort By:
Journal of Chemical Information and Modeling
|
December 4, 2023
Two-Step Covalent Docking with Attracting Cavities
Mathilde Goullieux, Vincent Zoete, Ute F Röhrig
Scientific Reports
|
November 26, 2025
Hybrid quantum/classical docking of covalent and non-covalent ligands with Attracting Cavities
Mathilde Goullieux, Vincent Zoete, Ute F Röhrig
The Journal of Physical Chemistry Letters
|
June 26, 2026
Impact of Initial Electron Localization on Electron Solvation Dynamics in Liquid Water
Nathaniel Okpara, Mathilde Goullieux, Ludger Inhester, et al.
Journal of Chemical Information and Modeling
|
June 7, 2023
Attracting Cavities 2.0: Improving the Flexibility and Robustness for Small-Molecule Docking
Ute F Röhrig, Mathilde Goullieux, Marine Bugnon, et al.
The Journal of Chemical Physics
|
February 24, 2026
Ultrafast radiation chemistry of glycine in aqueous solution
Mathilde Goullieux, Anthony Ferté, Ana Martinez Gutierrez, et al.
Journal of Chemical Information and Modeling
|
October 19, 2023
SwissParam 2023: A Modern Web-Based Tool for Efficient Small Molecule Parametrization
Marine Bugnon, Mathilde Goullieux, Ute F Röhrig, et al.
Nucleic Acids Research
|
April 30, 2024
SwissDock 2024: major enhancements for small-molecule docking with Attracting Cavities and AutoDock Vina
Marine Bugnon, Ute F Röhrig, Mathilde Goullieux, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Journal of Chemical Information and Modeling
|
December 4, 2023
Two-Step Covalent Docking with Attracting Cavities
Mathilde Goullieux, Vincent Zoete, Ute F Röhrig
Scientific Reports
|
November 26, 2025
Hybrid quantum/classical docking of covalent and non-covalent ligands with Attracting Cavities
Mathilde Goullieux, Vincent Zoete, Ute F Röhrig
The Journal of Physical Chemistry Letters
|
June 26, 2026
Impact of Initial Electron Localization on Electron Solvation Dynamics in Liquid Water
Nathaniel Okpara, Mathilde Goullieux, Ludger Inhester, et al.
Journal of Chemical Information and Modeling
|
June 7, 2023
Attracting Cavities 2.0: Improving the Flexibility and Robustness for Small-Molecule Docking
Ute F Röhrig, Mathilde Goullieux, Marine Bugnon, et al.
The Journal of Chemical Physics
|
February 24, 2026
Ultrafast radiation chemistry of glycine in aqueous solution
Mathilde Goullieux, Anthony Ferté, Ana Martinez Gutierrez, et al.
Journal of Chemical Information and Modeling
|
October 19, 2023
SwissParam 2023: A Modern Web-Based Tool for Efficient Small Molecule Parametrization
Marine Bugnon, Mathilde Goullieux, Ute F Röhrig, et al.
Nucleic Acids Research
|
April 30, 2024
SwissDock 2024: major enhancements for small-molecule docking with Attracting Cavities and AutoDock Vina
Marine Bugnon, Ute F Röhrig, Mathilde Goullieux, et al.
Page
of 1