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

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

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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,
        call={preparatory},
        acronym={FEPrepare},
        fulltitle={FEPrepare: A web-based tool for automating the setup of relative binding free energy calculations},
        pi={Zoe Cournia},
        affiliation={Biomedical Research Foundation, Academy of Athens},
        researchfield={Biochemistry, Bioinformatics and Life sciences},
        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},
}