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Journal of Computer-Aided Molecular Design
|
August 31, 2018
Blinded predictions of standard binding free energies: lessons learned from the SAMPL6 challenge
Michail Papadourakis, Stefano Bosisio, Julien Michel
Journal of Chemical Information and Modeling
|
July 8, 2024
Computational Investigation of BMAA and Its Carbamate Adducts as Potential GluR2 Modulators
Isidora Diakogiannaki, Michail Papadourakis, Vasileia Spyridaki, et al.
Computational and Structural Biotechnology Journal
|
September 4, 2024
Free energy landscape of the PI3Kα C-terminal activation
Danai Maria Kotzampasi, Michail Papadourakis, John E Burke, et al.
Journal of Chemical Theory and Computation
|
October 28, 2024
Comparison of Methodologies for Absolute Binding Free Energy Calculations of Ligands to Intrinsically Disordered Proteins
Michail Papadourakis, Zoe Cournia, Antonia S J S Mey, et al.
Chemical Science
|
June 3, 2022
Energetics of a protein disorder-order transition in small molecule recognition
Cesar Mendoza-Martinez, Michail Papadourakis, Salomé Llabrés, et al.
Journal of Chemical Information and Modeling
|
September 14, 2021
FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations
Stamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, et al.
Chemical Science
|
November 25, 2021
The effect of S427F mutation on RXRα activity depends on its dimeric partner
Ioannis Galdadas, Vangelis Bonis, Paraskevi Vgenopoulou, et al.
Journal of Chemical Information and Modeling
|
January 16, 2026
G.AI.A: An Integrated Machine-Learning Platform for Predicting Bioaccumulation and Ecotoxicity of Pharmaceuticals
Evangelos Tsoukas, Michail Papadourakis, Eleni Chontzopoulou, et al.
Current Opinion in Structural Biology
|
December 13, 2025
The current understanding of KRAS oligomerization on membranes
Nastazia Lesgidou, Michail Papadourakis, Nishita Mandal, et al.
Journal of Chemical Information and Modeling
|
October 20, 2025
Assessment of the Binding Patterns for Endocrine Disrupting Chemicals in Complex with Estrogen and Androgen Receptors by Leveraging the Asclepios Enalos KNIME Nodes
Haralampos Tzoupis, Michail Papadourakis, Konstantinos D Papavasileiou, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 17) with videos related to
Sort By:
Page
of 2
Journal of Computer-Aided Molecular Design
|
August 31, 2018
Blinded predictions of standard binding free energies: lessons learned from the SAMPL6 challenge
Michail Papadourakis, Stefano Bosisio, Julien Michel
Journal of Chemical Information and Modeling
|
July 8, 2024
Computational Investigation of BMAA and Its Carbamate Adducts as Potential GluR2 Modulators
Isidora Diakogiannaki, Michail Papadourakis, Vasileia Spyridaki, et al.
Computational and Structural Biotechnology Journal
|
September 4, 2024
Free energy landscape of the PI3Kα C-terminal activation
Danai Maria Kotzampasi, Michail Papadourakis, John E Burke, et al.
Journal of Chemical Theory and Computation
|
October 28, 2024
Comparison of Methodologies for Absolute Binding Free Energy Calculations of Ligands to Intrinsically Disordered Proteins
Michail Papadourakis, Zoe Cournia, Antonia S J S Mey, et al.
Chemical Science
|
June 3, 2022
Energetics of a protein disorder-order transition in small molecule recognition
Cesar Mendoza-Martinez, Michail Papadourakis, Salomé Llabrés, et al.
Journal of Chemical Information and Modeling
|
September 14, 2021
FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations
Stamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, et al.
Chemical Science
|
November 25, 2021
The effect of S427F mutation on RXRα activity depends on its dimeric partner
Ioannis Galdadas, Vangelis Bonis, Paraskevi Vgenopoulou, et al.
Journal of Chemical Information and Modeling
|
January 16, 2026
G.AI.A: An Integrated Machine-Learning Platform for Predicting Bioaccumulation and Ecotoxicity of Pharmaceuticals
Evangelos Tsoukas, Michail Papadourakis, Eleni Chontzopoulou, et al.
Current Opinion in Structural Biology
|
December 13, 2025
The current understanding of KRAS oligomerization on membranes
Nastazia Lesgidou, Michail Papadourakis, Nishita Mandal, et al.
Journal of Chemical Information and Modeling
|
October 20, 2025
Assessment of the Binding Patterns for Endocrine Disrupting Chemicals in Complex with Estrogen and Androgen Receptors by Leveraging the Asclepios Enalos KNIME Nodes
Haralampos Tzoupis, Michail Papadourakis, Konstantinos D Papavasileiou, et al.
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of 2