Michail Papadourakis

According to our database, Michail Papadourakis authored at least 7 papers between 2018 and 2026.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of five.

2026

G.AI.A: An Integrated Machine-Learning Platform for Predicting Bioaccumulation and Ecotoxicity of Pharmaceuticals.

Evangelos Tsoukas, Michail Papadourakis, Eleni Chontzopoulou, Spyridon Vythoulkas, Christos Didachos, Dionisis Cavouras, Panagiotis Zoumpoulakis, Minos-Timotheos Matsoukas

J. Chem. Inf. Model., 2026

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, Oliver Burk, Volker M. Lauschke, Andreas Tsoumanis, Georgia Melagraki, Antreas Afantitis

J. Chem. Inf. Model., 2025

2024

Identification of Small-Molecule Antagonists Targeting the Growth Hormone Releasing Hormone Receptor (GHRHR).

Minos-Timotheos Matsoukas, Tarryn Radomsky, Vasilis Panagiotopoulos, Robin du Preez, Michail Papadourakis, Konstantinos Tsianakas, Robert P. Millar, Ross C. Anderson, Georgios A Spyroulias, Claire L. Newton

J. Chem. Inf. Model., 2024

Computational Investigation of BMAA and Its Carbamate Adducts as Potential GluR2 Modulators.

Isidora Diakogiannaki, Michail Papadourakis, Vasileia Spyridaki, Zoe Cournia, Andreas Koutselos

J. Chem. Inf. Model., 2024

2021

FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations.

Stamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, Giorgio Amendola, Alexios Chatzigoulas, Dimitris Dellis, Sandro Cosconati, Zoe Cournia

J. Chem. Inf. Model., 2021

2020

The SAMPL6 SAMPLing challenge: assessing the reliability and efficiency of binding free energy calculations.

Andrea Rizzi, Travis Jensen, David R. Slochower, Matteo Aldeghi, Vytautas Gapsys, Dimitris Ntekoumes, Stefano Bosisio, Michail Papadourakis, Niel M. Henriksen, Bert L. de Groot, Zoe Cournia, Alex Dickson, Julien Michel, Michael K. Gilson, Michael R. Shirts, David L. Mobley, John D. Chodera

J. Comput. Aided Mol. Des., 2020

2018

Blinded predictions of standard binding free energies: lessons learned from the SAMPL6 challenge.

Michail Papadourakis, Stefano Bosisio, Julien Michel

J. Comput. Aided Mol. Des., 2018