Project Acronym: FEPrepareTitle: FEPrepare: A web-based tool for automating the setup of relative binding free energy calculationsAffiliation: biomedical research foundation, academy of athensPi: Zoe CourniaResearch Field: biochemistry, bioinformatics and life sciences
FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations
by Stamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, Giorgio Amendola, Alexios Chatzigoulas, Dimitris Dellis, Sandro Cosconati, Zoe Cournia
Reference:
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), In J. Chem. Inf. Model., volume 61, 2021.
Bibtex Entry:
@article{doi:10.1021-acs.jcim.1c00215,
author = {Stamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, Giorgio Amendola, Alexios Chatzigoulas, Dimitris Dellis, Sandro Cosconati, Zoe Cournia},
doi = {10.1021/acs.jcim.1c00215},
url = {https://doi.org/10.1021/acs.jcim.1c00215},
year = {2021},
bibyear = {2021},
journal = {J. Chem. Inf. Model.},
volume = {61},
number = {9},
pages = {4131},
title = {FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations},
}