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Machine learning algorithms

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  • PHOTONAI—A Python API for rapid machine learning model development

    Ramona Leenings, Nils Ralf Winter, Lucas Plagwitz, Vincent Holstein, Jan Ernsting, Kelvin Sarink, Lukas Fisch, Jakob Steenweg, Leon Kleine-Vennekate, Julian Gebker, Daniel Emden, Dominik Grotegerd, Nils Opel, Benjamin Risse, Xiaoyi Jiang, Udo Dannlowski, Tim Hahn

    published 21 Jul 2021

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  • A community-powered search of machine learning strategy space to find NMR property prediction models

    Lars A. Bratholm, Will Gerrard, Brandon Anderson, Shaojie Bai, Sunghwan Choi, Lam Dang, Pavel Hanchar, Addison Howard, Sanghoon Kim, Zico Kolter, Risi Kondor, Mordechai Kornbluth, Youhan Lee, Youngsoo Lee, Jonathan P. Mailoa, Thanh Tu Nguyen, Milos Popovic, Goran Rakocevic, Walter Reade, Wonho Song, Luka Stojanovic, Erik H. Thiede, Nebojsa Tijanic, Andres Torrubia, Devin Willmott, Craig P. Butts, David R. Glowacki

    published 20 Jul 2021

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