A Robotics-Inspired Screening Algorithm for Molecular Caging Prediction

Oleksandr Kravchenko, Anastasiia Varava, Florian T. Pokorny, Didier Devaurs, Lydia E. Kavraki, Danica Kragic. A Robotics-Inspired Screening Algorithm for Molecular Caging Prediction. Journal of Chemical Information and Computer Sciences, 60(3):1302-1316, 2020. [doi]

Authors

Oleksandr Kravchenko

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Anastasiia Varava

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Florian T. Pokorny

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Didier Devaurs

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Lydia E. Kavraki

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Danica Kragic

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