Ligand design for <sup>227</sup>Ac extraction by active learning and molecular topology

An active learning workflow that combines electronic structure and molecular topology was developed for the in silico design of organic ligands for actinium capture in solution.

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Publication Details

Journal
Digital Discovery
Published
2025-01-01
DOI
https://doi.org/10.1039/d5dd00007f
Citations
4
Primary Topic
Radiopharmaceutical Chemistry and Applications
Type
article
Field-Weighted Citation Impact
5.44

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article

Ligand design for 227Ac extraction by active learning and molecular topology

Jeffrey A. Laub, Konstantinos D. Vogiatzis
4 citations
Digital Discovery
Radiopharmaceutical Chemistry and Applications
5.44
article

Ligand design for 227Ac extraction by active learning and molecular topology

Jeffrey A. Laub, Konstantinos D. Vogiatzis
article en
4 citations

Abstract

An active learning workflow that combines electronic structure and molecular topology was developed for the in silico design of organic ligands for actinium capture in solution.

Digital DiscoveryVol. 4(4)
University of Tennessee at Knoxville (US)
National Science Foundation
Openalex Percentile: Top 5%
Radiopharmaceutical Chemistry and Applications
5.44
DOIOpen Access PDFOpenAlex
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Ligand design for <sup>227</sup>Ac extraction by active learning and molecular topology — Jeffrey A. Laub, Konstantinos D. Vogiatzis · Digital Discovery (2025) | TGRS Research Map | TGRS