Secondary structure elements in polylactic acid models

DOI10.1007/S10910-011-9919-ZMaRDI QIDQ427412zbMATH OpenOpenAlexFDO

Authors Izabella Irsai, Cornelia Majdik, Alexandru Lupan, Radu Silaghi-Dumitrescu

Publication date 13 June 2012

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/s10910-011-9919-z

zbMATH Keywords

tablesDFTmolecular modelingnoncovalent interaction

Mathematics Subject Classification ID

Computational methods for problems pertaining to biology (92-08) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

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Cited in

(2)

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Uses Software

• HyperChem
• MOPAC
• GAUSSIAN

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