WebDescription: This is an extensive collection of physical property data for polymers and monomers by CRC Press. The electronic handbook may besearched by keyword, or by ranges of property values. Materials Indexed: Factual Information, Technical Data Database Type: Dictionary, Encyclopedia, Handbook Interface Language: English Materials … WebMar 12, 2024 · The inconsistency of polymer indexing caused by the lack of uniformity in expression of polymer names is a major challenge for widespread use of polymer related data resources and limits broad application of materials informatics for innovation in broad classes of polymer science and polymeric based materials. The current solution of using …
Polymers An Open Access Journal from MDPI
WebHowever, since the database uses the SMILES strings of the polymer repeat units for polymer representation, the inclusion of polymerization point ‘[*]’ in the SMILES strings brings several difficulties for common cheminformatics packages to generate molecular descriptors or fingerprints, which have been extensively used in polymer informatics … WebJan 27, 2016 · The COMPASS II force field has been developed by extending the coverage of the COMPASS force field (J Phys Chem B 102(38):7338–7364, 1998) to polymer and drug-like molecules found in popular databases. Using a fragmentation method to systematically construct small molecules that exhibit key functional groups found in these databases, … foals cheval
Infrared and Raman Databases of Reference Spectra ACD/Labs
WebBroad coverage with access to over 150 databases covering a wide range of compounds. From organics and inorganics to application-focused data, we’ve got you covered! Along with spectra, records contain physical properties and structures when available; ... Polymers & Related Compounds ... WebDescription. We aim to generate the data necessary for polymer informatics by developing information extraction pipelines to automatically extract polymer properties from the literature. We use natural language processing software (ChemDataExtractor) to extract both names of chemical entities and properties automatically from journal articles. Webnaming of polymers: source-based and structure-based. Overviews of each system can be found in several reference books, including the Polrmer Handbook1 and the most recent C RC Handbook, 2 as well as in int;oductory-level polymer chemistry texts such as that by Odian.3 Source-based naming derives the polymer name from the monomer or foals chicago