Transfer learning across different chemical domains: virtual screening of organic materials with deep learning models pretrained on small molecule and chemical reaction data
Author:
Funder
National Natural Science Foundation of China
Joint Funds of the Zhejiang Provincial Natural Science Foundation of China
Key Research and Development Program of Zhejiang Province
Publisher
Springer Science and Business Media LLC
Link
https://link.springer.com/content/pdf/10.1186/s13321-024-00886-1.pdf
Reference49 articles.
1. Ostroverkhova O (2016) Organic optoelectronic materials: mechanisms and applications. Chem Rev 116(22):13279–13412
2. Hedley GJ, Ruseckas A, Samuel IDW (2017) Light harvesting for organic photovoltaics. Chem Rev 117(2):796–837
3. Zou S-J, Shen Y, Xie F-M, Chen J-D, Li Y-Q, Tang J-X (2020) Recent advances in organic light-emitting diodes: toward smart lighting and displays. Mater Chem Front 4(3):788–820
4. Luo J, Hu B, Hu M, Zhao Y, Liu TL (2019) Status and prospects of organic redox flow batteries toward sustainable energy storage. ACS Energy Lett 4(9):2220–2240
5. Stokes JM, Yang K, Swanson K, Jin W, Cubillos-Ruiz A, Donghia NM, MacNair CR, French S, Carfrae LA, Bloom-Ackermann Z, Tran VM, Chiappino-Pepe A, Badran AH, Andrews IW, Chory EJ, Church GM, Brown ED, Jaakkola TS, Barzilay R, Collins JJ (2020) A deep learning approach to antibiotic discovery. Cell 181(2):475–483
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3