Integrating Computational and Experimental Workflows for Accelerated Organic Materials Discovery-Reference-Cited by-同舟云学术

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Integrating Computational and Experimental Workflows for Accelerated Organic Materials Discovery

Published:2021-02-09 Issue:11 Volume:33 Page:2004831
ISSN:0935-9648
Container-title:Advanced Materials
language:en
Short-container-title:Adv. Mater.

Author:

Greenaway Rebecca L.¹^ORCID,Jelfs Kim E.¹^ORCID

Affiliation:

1. Department of Chemistry Imperial College London Molecular Sciences Research Hub White City Campus, Wood Lane London W12 0BZ UK

Funder

European Research Council

Publisher

Wiley

Subject

Mechanical Engineering,Mechanics of Materials,General Materials Science

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/adma.202004831

Reference69 articles.

1. Rational development of new materials — putting the cart before the horse?

2. Estimation of the size of drug-like chemical space based on GDB-17 data

3. Molecular generation targeting desired electronic properties via deep generative models

4. Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions

5. SNOBFIT -- Stable Noisy Optimization by Branch and Fit

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