Interaction of 5‑Fluorouracil on the Surfaces of Pristine and Functionalized Ca12O12 Nanocages: An Intuition from DFT

• Goodness J. Ogunwale,
• Hitler Louis,
• Tomsmith O. Unimuke,
• Gideon E. Mathias,
• Aniekan E. Owen,
• Henry O. Edet,
• Obieze C. Enudi,
• Esther O. Oluwasanmi,
• Adedapo S. Adeyinka,
• Mohsen Doust Mohammadi

Affiliations

Goodness J. Ogunwale

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Hitler Louis

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Tomsmith O. Unimuke

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Gideon E. Mathias

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Aniekan E. Owen

School of Chemistry, University of St Andrews, St Andrews, Scotland

Henry O. Edet

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Obieze C. Enudi

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Esther O. Oluwasanmi

Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria

Adedapo S. Adeyinka

Department of Chemical Sciences, University of Johannesburg, Johannesburg, South-Africa

Mohsen Doust Mohammadi

School of Chemistry, College of Science, University of Tehran, Tehran, Iran