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From 2015 to 2023: How Machine Learning Aids Natural Product Analysis

arXiv 2408.00793 ↗First posted 18 Jul 2024physics.chem-ph cs.LGcited by 0

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Abstract (arXiv)

In recent years, conventional chemistry techniques have faced significant challenges due to their inherent limitations, struggling to cope with the increasing complexity and volume of data generated in contemporary research endeavors. Computational methodologies represent robust tools in the field of chemistry, offering the capacity to harness potent machine-learning models to yield insightful analytical outcomes. This review delves into the spectrum of computational strategies available for natural product analysis and constructs a research framework for investigating both qualitative and quantitative chemistry problems. Our objective is to present a novel perspective on the symbiosis of machine learning and chemistry, with the potential to catalyze a transformation in the field of natural product analysis.

Key facts. No citing papers in the map yet (data through 7 Oct 2026). Builds on 3 of its 130 references that are in the map. First posted on arXiv 18 Jul 2024.

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References · 3

  1. 2017Learning to Plan Chemical Synthesescited by 175
  2. 2019Unifying machine learning and quantum chemistry -- a deep neural network for molecular wavefunctionscited by 73
  3. 2020On Mean Absolute Error for Deep Neural Network Based Vector-to-Vector Regressioncited by 33

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