L. Tavagnacco, M. Zanatta, E. Buratti, B. Rosi, B. Frick, F. Natali, J. Ollivier, E. Chiessi, M. Bertoldo, E. Zaccarelli, A. Orecchini
{"title":"水合聚合物链的类蛋白质动态转变","authors":"L. Tavagnacco, M. Zanatta, E. Buratti, B. Rosi, B. Frick, F. Natali, J. Ollivier, E. Chiessi, M. Bertoldo, E. Zaccarelli, A. Orecchini","doi":"10.1103/PHYSREVRESEARCH.3.013191","DOIUrl":null,"url":null,"abstract":"Combining elastic incoherent neutron scattering experiments at different resolutions and molecular dynamics simulations, we report the observation of a protein-like dynamical transition in Poly(N-isopropylacrylamide) chains. We identify the onset of the transition at a temperature Td of about 225~K. Thanks to a novel global fit procedure, we find quantitative agreement between measured and calculated polymer mean-squared displacements at all temperatures and time resolutions. Our results confirm the generality of the dynamical transition in macromolecular systems in aqueous environments, independently of the internal polymer topology.","PeriodicalId":8472,"journal":{"name":"arXiv: Soft Condensed Matter","volume":"58 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2020-07-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"7","resultStr":"{\"title\":\"Proteinlike dynamical transition of hydrated polymer chains\",\"authors\":\"L. Tavagnacco, M. Zanatta, E. Buratti, B. Rosi, B. Frick, F. Natali, J. Ollivier, E. Chiessi, M. Bertoldo, E. Zaccarelli, A. Orecchini\",\"doi\":\"10.1103/PHYSREVRESEARCH.3.013191\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Combining elastic incoherent neutron scattering experiments at different resolutions and molecular dynamics simulations, we report the observation of a protein-like dynamical transition in Poly(N-isopropylacrylamide) chains. We identify the onset of the transition at a temperature Td of about 225~K. Thanks to a novel global fit procedure, we find quantitative agreement between measured and calculated polymer mean-squared displacements at all temperatures and time resolutions. Our results confirm the generality of the dynamical transition in macromolecular systems in aqueous environments, independently of the internal polymer topology.\",\"PeriodicalId\":8472,\"journal\":{\"name\":\"arXiv: Soft Condensed Matter\",\"volume\":\"58 1\",\"pages\":\"\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2020-07-23\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"7\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"arXiv: Soft Condensed Matter\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1103/PHYSREVRESEARCH.3.013191\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"arXiv: Soft Condensed Matter","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1103/PHYSREVRESEARCH.3.013191","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Proteinlike dynamical transition of hydrated polymer chains
Combining elastic incoherent neutron scattering experiments at different resolutions and molecular dynamics simulations, we report the observation of a protein-like dynamical transition in Poly(N-isopropylacrylamide) chains. We identify the onset of the transition at a temperature Td of about 225~K. Thanks to a novel global fit procedure, we find quantitative agreement between measured and calculated polymer mean-squared displacements at all temperatures and time resolutions. Our results confirm the generality of the dynamical transition in macromolecular systems in aqueous environments, independently of the internal polymer topology.