期刊
POLIMERY
卷 66, 期 5, 页码 293-297出版社
INDUSTRIAL CHEMISTRY RESEARCH INST
DOI: 10.14314/polimery.2021.5.2
关键词
computer design of macromolecules
资金
- Consejo Nacional de Investigaciones Cientificas y Tecnicas (CONICET), Argentina [PIP 112-2017-0100829]
- Universidad Nacional del Sur (UNS), Bahia Blanca, Argentina [PGI 24/N042, PGI 24/ZM17]
- Agencia Nacional de Promocion Cientifica y Tecnologica [PICT 2018-04533, PICT-2019-03350]
The PolyMaS software utilizes SMILES codes to generate linear macromolecules without limiting their length and molar mass, and can adjust the length of the polymer as needed.
The Polymer Maker SMILES-based (PolyMaS) software was used to generate linear macromolecules from the repeating structural units (SRU) of polymers without limiting their length and molar mass. The SRU input is stored in the SMILES code available on the Internet. PolyMaS makes head-tail junctions to the desired length of the macromolecule.
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