Novel Computational Chemistry Infrastructure for Simulating Astatide in Water: From Basis Sets to Force Fields Using Particle Swarm Optimization

Author:

Rueda Espinosa Kennet J.1,Kananenka Alexei A.1,Rusakov Alexander A.2ORCID

Affiliation:

1. Department of Physics and Astronomy, University of Delaware, Newark, Delaware 19716, United States

2. Department of Chemistry, Oakland University, Rochester, Michigan 48309, United States

Funder

Universidad Nacional de Colombia

National Institutes of Health

Oakland University

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Reference142 articles.

1. Nations join together to announce the World Astatine Community. https://www.isotopes.gov/WAC (accessed June 26, 2023).

2. World Astatine Community expands access to cancer-fighting At-211. https://www.ans.org/news/article-5099/world-astatine-community-expands-access-to-cancerfighting-at211/ (accessed June 26, 2023).

3. The 12th International Symposium on Targeted Alpha Therapy (TAT 12). https://tat-12.com (accessed June 26, 2023).

4. Recent progress of astatine-211 in endoradiotherapy: Great advances from fundamental properties to targeted radiopharmaceuticals

5. Advances in the Chemistry of Astatine and Implications for the Development of Radiopharmaceuticals

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