CAT: A Compound Attachment Tool for the Construction of Composite Chemical Compounds-Reference-Cited by-同舟云学术

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CAT: A Compound Attachment Tool for the Construction of Composite Chemical Compounds

Published:2022-10-31 Issue:22 Volume:62 Page:5525-5535
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

van Beek Bas¹,Zito Juliette²³^ORCID,Visscher Lucas¹^ORCID,Infante Ivan³⁴⁵^ORCID

Affiliation:

1. Division of Theoretical Chemistry, Faculty of Science, Vrije Universiteit Amsterdam, de Boelelaan 1083, Amsterdam 1081 HV, the Netherlands

2. Dipartimento di Chimica e Chimica Industriale, Università degli Studi di Genova, Via Dodecaneso 31, Genova 16146, Italy

3. Department of Nanochemistry, Istituto Italiano di Tecnologia, Via Morego 30, Genova 16163, Italy

4. BCMaterials, Basque Center for Materials, Applications, and Nanostructures, UPV/EHU Science Park, Leioa 48940, Spain

5. Ikerbasque Basque Foundation for Science Bilbao 48009, Spain

Funder

Nederlandse Organisatie voor Wetenschappelijk Onderzoek

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.2c00690

Reference88 articles.

1. Machine learning for molecular and materials science

2. Materials discovery and design using machine learning

3. Design of efficient molecular organic light-emitting diodes by a high-throughput virtual screening and experimental approach

4. The Harvard Clean Energy Project: Large-Scale Computational Screening and Design of Organic Photovoltaics on the World Community Grid

5. Basic Overview of Chemoinformatics

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