Discovery of Novel Adenosine Receptor Antagonists through a Combined Structure- and Ligand-Based Approach Followed by Molecular Dynamics Investigation of Ligand Binding Mode (bibtex)

by Lagarias, Panagiotis, Vrontaki, Eleni, Lambrinidis, George, Stamatis, Dimitrios, Convertino, Marino, Ortore, Gabriella, Mavromoustakos, Thomas, Klotz, Karl-Norbert and Kolocouris, Antonios

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Discovery of Novel Adenosine Receptor Antagonists through a Combined Structure- and Ligand-Based Approach Followed by Molecular Dynamics Investigation of Ligand Binding Mode (Lagarias, Panagiotis, Vrontaki, Eleni, Lambrinidis, George, Stamatis, Dimitrios, Convertino, Marino, Ortore, Gabriella, Mavromoustakos, Thomas, Klotz, Karl-Norbert and Kolocouris, Antonios), In Journal of Chemical Information and Modeling, volume 58, 2018.

Bibtex Entry:

@article{doi:10.1021/acs.jcim.7b00455,
    author = {Lagarias, Panagiotis and Vrontaki, Eleni and Lambrinidis, George and Stamatis, Dimitrios and Convertino, Marino and Ortore, Gabriella and Mavromoustakos, Thomas and Klotz, Karl-Norbert and Kolocouris, Antonios},
    title = {Discovery of Novel Adenosine Receptor Antagonists through a Combined Structure- and Ligand-Based Approach Followed by Molecular Dynamics Investigation of Ligand Binding Mode},
    journal = {Journal of Chemical Information and Modeling},
    volume = {58},
    number = {4},
    pages = {794-815},
    year = {2018},
    bibyear = {2018},
    doi = {10.1021/acs.jcim.7b00455},
    note ={PMID: 29485875},
    URL = {https://doi.org/10.1021/acs.jcim.7b00455},
    eprint = {https://doi.org/10.1021/acs.jcim.7b00455},
    call={pr004},
    acronym={CADD_AKPL},
    fulltitle={Computer-Aided Drug Design for Adenosine GPCRs},
    pi={Antonios Kolocouris},
    affiliation={National and Kapodistrian University of Athens},
    researchfield={Biochemistry, Bioinformatics and Life sciences}
}