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

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Stamatia Zavitsanou, Alexandros Tsengenes, Michail Papadourakis, Giorgio Amendola, Alexios Chatzigoulas, Dimitris Dellis, Sandro Cosconati, Zoe Cournia. FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations. Journal of Chemical Information and Computer Sciences, 61(9):4131-4138, 2021. [doi]

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