SELFIES and the future of molecular string representations

Mario Krenn, Qianxiang Ai, Senja Barthel, Nessa Carson, Angelo Frei, Nathan C. Frey, Pascal Friederich, Théophile Gaudin, Alberto Alexander Gayle, Kevin Maik Jablonka, Rafael F. Lameiro, Dominik Lemm, Alston Lo, Seyed Mohamad Moosavi, José Manuel Nápoles-Duarte, AkshatKumar Nigam, Robert Pollice, Kohulan Rajan, Ulrich Schatzschneider, Philippe Schwaller, Marta Skreta, Berend Smit, Felix Strieth-Kalthoff, Chong Sun, Gary Tom, Guido Falk von Rudorff, Andrew Wang, Andrew D. White, Adamo Young, Rose Yu, Alán Aspuru-Guzik. SELFIES and the future of molecular string representations. Patterns, 3(10):100588, 2022. [doi]

Authors

Mario Krenn

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Qianxiang Ai

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Senja Barthel

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Nessa Carson

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Angelo Frei

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Nathan C. Frey

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Pascal Friederich

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Théophile Gaudin

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Alberto Alexander Gayle

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Kevin Maik Jablonka

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Rafael F. Lameiro

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Dominik Lemm

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Alston Lo

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Seyed Mohamad Moosavi

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José Manuel Nápoles-Duarte

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AkshatKumar Nigam

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Robert Pollice

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Kohulan Rajan

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Ulrich Schatzschneider

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Philippe Schwaller

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Marta Skreta

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Berend Smit

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Felix Strieth-Kalthoff

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Chong Sun

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Gary Tom

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Guido Falk von Rudorff

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Andrew Wang

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Andrew D. White

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Adamo Young

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Rose Yu

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Alán Aspuru-Guzik

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