Publications

Project Acronym: FEPrepare
Title: FEPrepare: A web-based tool for automating the setup of relative binding free energy calculations
Affiliation: biomedical research foundation, academy of athens
Pi: Zoe Cournia
Research 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},
}