Modern machine learning for tackling inverse problems in chemistry: molecular design to realization.
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DOI: 10.1039/d1cc07035e
Abstract: The discovery of new molecules and materials helps expand the horizons of novel and innovative real-life applications. In pursuit of finding molecules with desired properties, chemists have traditionally relied on experimentation and recently on combinatorial… read more here.
Keywords: inverse problems; chemistry; machine learning; problems chemistry ... See more keywords