Michail Papadourakis

According to our database, Michail Papadourakis authored at least 3 papers between 2018 and 2021.

Collaborative distances:

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

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