Scaffold-Retained Structure Generator to Exhaustively Create Molecules in an Arbitrary Chemical Space-Reference-Cited by-同舟云学术

Scaffold-Retained Structure Generator to Exhaustively Create Molecules in an Arbitrary Chemical Space

Published:2022-02-21 Issue:9 Volume:62 Page:2212-2225
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Kaitoh Kazuma¹^ORCID,Yamanishi Yoshihiro¹^ORCID

Affiliation:

1. Department of Bioscience and Bioinformatics, Faculty of Computer Science and Systems Engineering, Kyushu Institute of Technology, 680-4 Kawazu, Iizuka, Fukuoka 820-8502, Japan

Funder

Japan Agency for Medical Research and Development

Japan Society for the Promotion of Science

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.1c01130

Reference102 articles.

1. Innovation in the pharmaceutical industry: New estimates of R&D costs

2. The application of discovery toxicology and pathology towards the design of safer pharmaceutical lead candidates

3. The Synthesizability of Molecules Proposed by Generative Models

4. Novel trends in high-throughput screening

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