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FEPrepare: A Web-Based Tool for Automating the Setup of Relative Binding Free Energy Calculations.
Zavitsanou, Stamatia; Tsengenes, Alexandros; Papadourakis, Michail; Amendola, Giorgio; Chatzigoulas, Alexios; Dellis, Dimitris; Cosconati, Sandro; Cournia, Zoe.
Affiliation
  • Zavitsanou S; Biomedical Research Foundation, Academy of Athens, 4 Soranou Ephessiou, 11527 Athens, Greece.
  • Tsengenes A; Information Technologies in Medicine and Biology, Department of Informatics and Telecommunications, National and Kapodistrian University of Athens, 15784 Athens, Greece.
  • Papadourakis M; Biomedical Research Foundation, Academy of Athens, 4 Soranou Ephessiou, 11527 Athens, Greece.
  • Amendola G; Biomedical Research Foundation, Academy of Athens, 4 Soranou Ephessiou, 11527 Athens, Greece.
  • Chatzigoulas A; DiSTABiF, Università della Campania Luigi Vanvitelli, Via Vivaldi 43, 81100 Caserta, Italy.
  • Dellis D; Biomedical Research Foundation, Academy of Athens, 4 Soranou Ephessiou, 11527 Athens, Greece.
  • Cosconati S; Information Technologies in Medicine and Biology, Department of Informatics and Telecommunications, National and Kapodistrian University of Athens, 15784 Athens, Greece.
  • Cournia Z; Greek Research and Technology Network, S.A., 7 Kifissias Avenue, 11523 Athens, Greece.
J Chem Inf Model ; 61(9): 4131-4138, 2021 09 27.
Article in En | MEDLINE | ID: mdl-34519200
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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Internet / Molecular Dynamics Simulation Language: En Journal: J Chem Inf Model Journal subject: INFORMATICA MEDICA / QUIMICA Year: 2021 Document type: Article Affiliation country:
Fulltext
Add to My VHL
Print
XML
PubMed Links
Search on Google

Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Internet / Molecular Dynamics Simulation Language: En Journal: J Chem Inf Model Journal subject: INFORMATICA MEDICA / QUIMICA Year: 2021 Document type: Article Affiliation country: