POLYLACTIC ACID INTERACTIONS WITH BIOCERAMIC SURFACES

Izabella IRSAI; Adrian M.V. BRÂNZANIC; Radu SILAGHI-DUMITRESCU

doi:10.24193/subbchem.2021.3.06

POLYLACTIC ACID INTERACTIONS WITH BIOCERAMIC SURFACES

Authors

Izabella IRSAI Babeş-Bolyai University, Faculty of Chemistry and Chemical Engineering, 11 Arany Janos str., RO-400028, Cluj-Napoca, Romania.
Adrian M.V. BRÂNZANIC Babeş-Bolyai University, Institute of Interdisciplinary Research in Bio-Nano-Sciences, 42 Treboniu Laurian str., RO- 400271, Cluj-Napoca, Romania. https://orcid.org/0000-0002-4166-0131
Radu SILAGHI-DUMITRESCU Babeş-Bolyai University, Faculty of Chemistry and Chemical Engineering, 11 Arany Janos str., RO-400028, Cluj-Napoca, Romania. *Corresponding author: radu.silaghi@ubbcluj.ro https://orcid.org/0000-0003-3038-7747

DOI:

https://doi.org/10.24193/subbchem.2021.3.06

Keywords:

polylactic acid, hydroxyapatite, zirconia, molecular dynamics, weak interactions.

Abstract

Molecular dynamics simulations were employed in order to analyze the interfacial interaction of polylactic acids with zirconia and hydroxyapatite surfaces. The interactions of polymers on five crystallographic planes were simulated. Silane coupling agents can improve the interactions between the bioceramic surfaces and the polylactic acids. The effects of the coupling agents are more evident in the presence of hydroxyapatite surfaces. Weak interactions hold together the polylactic acids and bioceramic systems. These interactions are formed between the hydrogen atoms from methyl groups or from the main chains of the polylactic acids and the oxygens of the surfaces. Polylactic acids change their conformations after molecular dynamics simulations due to the interactions. The conformation changes are more obvious when silane coupling agents are added to the polylactic acids and bioceramic systems.

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STUDIA UBB CHEMIA, Volume 66 (LXVI), No. 3, September 2021

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Published

2021-09-30

How to Cite

IRSAI, I., BRÂNZANIC, A. M., & SILAGHI-DUMITRESCU, R. (2021). POLYLACTIC ACID INTERACTIONS WITH BIOCERAMIC SURFACES . Studia Universitatis Babeș-Bolyai Chemia, 66(3), 107–121. https://doi.org/10.24193/subbchem.2021.3.06