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Kostiantyn Gavrylenko
Kostiantyn Gavrylenko
Computer science
Chemical space
library design
Molecule
Medicinal chemistry
2
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SynthI: a new open-source tool for synthon-based library design
2021
ChemRxiv
Yuliana Zabolotna
Dmitriy M. Volochnyuk
Sergey V. Ryabukhin
Kostiantyn Gavrylenko
Dragos Horvath
Olga Klimchuk
Olexandr Oksiuta
Gilles Marcou
Alexandre Varnek
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A close-up look at the chemical space of commercially available building blocks for medicinal chemistry
2021
ChemRxiv
Yuliana Zabolotna
Dmitriy M. Volochnyuk
Sergey V. Ryabukhin
Dragos Horvath
Kostiantyn Gavrylenko
Gilles Marcou
Yurii S. Moroz
Olexandr Oksiuta
Alexandre Varnek
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