{"id":"https://openalex.org/W2054903322","doi":"https://doi.org/10.1039/c1sm05264k","title":"Study of volume phase transitions in polymeric nanogels by theoretically informed coarse-grained simulations","display_name":"Study of volume phase transitions in polymeric nanogels by theoretically informed coarse-grained simulations","publication_year":2011,"publication_date":"2011-01-01","ids":{"openalex":"https://openalex.org/W2054903322","doi":"https://doi.org/10.1039/c1sm05264k","mag":"2054903322"},"language":"en","primary_location":{"id":"doi:10.1039/c1sm05264k","doi":"https://doi.org/10.1039/c1sm05264k","is_oa":false,"landing_page_url":"https://doi.org/10.1039/c1sm05264k","pdf_url":null,"source":{"id":"https://openalex.org/S6377669","display_name":"Soft Matter","issn_l":"1744-683X","issn":["1744-683X","1744-6848"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-b","jufo-2","medline","norway-2","poland-100","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320556","host_organization_name":"Royal Society of Chemistry","host_organization_lineage":["https://openalex.org/P4310320556"],"host_organization_lineage_names":["Royal Society of Chemistry"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Soft Matter","raw_type":"journal-article"},"volume":null,"type":"article","indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5061813642","display_name":"Prateek K. Jha","orcid":"https://orcid.org/0000-0001-9844-2875","observed_orcids":["https://orcid.org/0000-0001-9844-2875"]},"institutions":[{"id":"https://openalex.org/I111979921","display_name":"Northwestern University","ror":"https://ror.org/000e0be47","country_code":"US","type":"education","lineage":["https://openalex.org/I111979921"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Prateek K. Jha","raw_affiliation_strings":["Department of Chemical and Biological Engineering, Evanston, IL, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical and Biological Engineering, Evanston, IL, USA","institution_ids":["https://openalex.org/I111979921"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5047346181","display_name":"Jos W. Zwanikken","orcid":"https://orcid.org/0000-0003-4190-8915","observed_orcids":["https://orcid.org/0000-0003-4190-8915"]},"institutions":[{"id":"https://openalex.org/I111979921","display_name":"Northwestern University","ror":"https://ror.org/000e0be47","country_code":"US","type":"education","lineage":["https://openalex.org/I111979921"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Jos W. Zwanikken","raw_affiliation_strings":["Department of Materials Science and Engineering, Evanston, IL, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Materials Science and Engineering, Evanston, IL, USA","institution_ids":["https://openalex.org/I111979921"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5082727499","display_name":"Fran\u00e7ois Detcheverry","orcid":"https://orcid.org/0000-0002-2987-9042","observed_orcids":["https://orcid.org/0000-0002-2987-9042"]},"institutions":[{"id":"https://openalex.org/I100532134","display_name":"Lyon 1 Universit\u00e9","ror":"https://ror.org/029brtt94","country_code":"FR","type":"education","lineage":["https://openalex.org/I100532134","https://openalex.org/I203339264"]},{"id":"https://openalex.org/I1294671590","display_name":"Centre National de la Recherche Scientifique","ror":"https://ror.org/02feahw73","country_code":"FR","type":"government","lineage":["https://openalex.org/I1294671590"]}],"countries":["FR"],"is_corresponding":false,"raw_author_name":"Fran\u00e7ois A. Detcheverry","raw_affiliation_strings":["LPMCN, Universite de Lyon, Universite Lyon 1 and CNRS, UMR 5586, Villeurbanne, France"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"LPMCN, Universite de Lyon, Universite Lyon 1 and CNRS, UMR 5586, Villeurbanne, France","institution_ids":["https://openalex.org/I100532134","https://openalex.org/I1294671590"]}]},{"author_position":"middle","author":{"id":null,"display_name":"Juan J. de Pablo","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I135310074","display_name":"University of Wisconsin\u2013Madison","ror":"https://ror.org/01y2jtd41","country_code":"US","type":"education","lineage":["https://openalex.org/I135310074"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Juan J. de Pablo","raw_affiliation_strings":["Department of Chemical and Biological Engineering, University of Wisconsin, Madison, WI, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical and Biological Engineering, University of Wisconsin, Madison, WI, USA","institution_ids":["https://openalex.org/I135310074"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5068153815","display_name":"M\u00f3nica Olvera de la Cruz","orcid":"https://orcid.org/0000-0002-9802-3627","observed_orcids":["https://orcid.org/0000-0002-9802-3627"]},"institutions":[{"id":"https://openalex.org/I111979921","display_name":"Northwestern University","ror":"https://ror.org/000e0be47","country_code":"US","type":"education","lineage":["https://openalex.org/I111979921"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Monica Olvera de la Cruz","raw_affiliation_strings":["Department of Chemical and Biological Engineering, Evanston, IL, USA","Department of Chemistry, Northwestern University, Evanston, IL, USA","Department of Materials Science and Engineering, Evanston, IL, USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemical and Biological Engineering, Evanston, IL, USA","institution_ids":["https://openalex.org/I111979921"]},{"raw_affiliation_string":"Department of Chemistry, Northwestern University, Evanston, IL, USA","institution_ids":["https://openalex.org/I111979921"]},{"raw_affiliation_string":"Department of Materials Science and Engineering, Evanston, IL, USA","institution_ids":["https://openalex.org/I111979921"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":4,"corresponding_author_ids":["https://openalex.org/A5068153815"],"corresponding_institution_ids":["https://openalex.org/I111979921"],"apc_list":null,"apc_paid":null,"fwci":2.632,"has_fulltext":false,"cited_by_count":85,"citation_normalized_percentile":{"value":0.88415286,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":99},"biblio":{"volume":"7","issue":"13","first_page":"5965","last_page":"5965"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10343","display_name":"Hydrogels: synthesis, properties, applications","score":0.7670999765396118,"subfield":{"id":"https://openalex.org/subfields/1313","display_name":"Molecular Medicine"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},"topics":[{"id":"https://openalex.org/T10343","display_name":"Hydrogels: synthesis, properties, applications","score":0.7670999765396118,"subfield":{"id":"https://openalex.org/subfields/1313","display_name":"Molecular Medicine"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T11737","display_name":"Advanced Materials and Mechanics","score":0.04349999874830246,"subfield":{"id":"https://openalex.org/subfields/2210","display_name":"Mechanical Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T12044","display_name":"Advanced Physical and Chemical Molecular Interactions","score":0.03550000116229057,"subfield":{"id":"https://openalex.org/subfields/1606","display_name":"Physical and Theoretical Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/polymeric-nanogels","display_name":"polymer nanogels","score":0.972000002861023},{"id":"https://openalex.org/keywords/volume-phase-transition","display_name":"volume phase transition","score":0.8650000095367432},{"id":"https://openalex.org/keywords/polymer-solvent-interactions","display_name":"polymer-solvent interactions","score":0.9399999976158142},{"id":"https://openalex.org/keywords/poisson-equation","display_name":"Poisson equation","score":0.7329999804496765},{"id":"https://openalex.org/keywords/crosslink-density","display_name":"crosslink density","score":0.8840000033378601},{"id":"https://openalex.org/keywords/solvent-quality","display_name":"solvent quality","score":0.9929999709129333},{"id":"https://openalex.org/keywords/charge-fraction","display_name":"charge fraction","score":0.6420000195503235}],"concepts":[{"id":"https://openalex.org/C134424308","wikidata":"https://www.wikidata.org/wiki/Q4119000","display_name":"Nanogel","level":3,"score":0.906306266784668},{"id":"https://openalex.org/C192562407","wikidata":"https://www.wikidata.org/wiki/Q228736","display_name":"Materials science","level":0,"score":0.6005809903144836},{"id":"https://openalex.org/C521977710","wikidata":"https://www.wikidata.org/wiki/Q81163","display_name":"Polymer","level":2,"score":0.5669167041778564},{"id":"https://openalex.org/C121864883","wikidata":"https://www.wikidata.org/wiki/Q677916","display_name":"Statistical physics","level":1,"score":0.513654887676239},{"id":"https://openalex.org/C19499675","wikidata":"https://www.wikidata.org/wiki/Q232207","display_name":"Monte Carlo method","level":2,"score":0.49710896611213684},{"id":"https://openalex.org/C159467904","wikidata":"https://www.wikidata.org/wiki/Q2001702","display_name":"Chemical physics","level":1,"score":0.4897921085357666},{"id":"https://openalex.org/C2780471494","wikidata":"https://www.wikidata.org/wiki/Q146505","display_name":"Solvent","level":2,"score":0.4815945327281952},{"id":"https://openalex.org/C73000952","wikidata":"https://www.wikidata.org/wiki/Q17007827","display_name":"Discretization","level":2,"score":0.4595652222633362},{"id":"https://openalex.org/C163716315","wikidata":"https://www.wikidata.org/wiki/Q901177","display_name":"Gaussian","level":2,"score":0.44430315494537354},{"id":"https://openalex.org/C65590680","wikidata":"https://www.wikidata.org/wiki/Q909482","display_name":"Volume fraction","level":2,"score":0.42758625745773315},{"id":"https://openalex.org/C171250308","wikidata":"https://www.wikidata.org/wiki/Q11468","display_name":"Nanotechnology","level":1,"score":0.28121089935302734},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.20896634459495544},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.2039201557636261},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.18044617772102356},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.11797964572906494},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.11036986112594604},{"id":"https://openalex.org/C2779820397","wikidata":"https://www.wikidata.org/wiki/Q1392806","display_name":"Drug delivery","level":2,"score":0.10007181763648987},{"id":"https://openalex.org/C159985019","wikidata":"https://www.wikidata.org/wiki/Q181790","display_name":"Composite material","level":1,"score":0.08159807324409485},{"id":"https://openalex.org/C134306372","wikidata":"https://www.wikidata.org/wiki/Q7754","display_name":"Mathematical analysis","level":1,"score":0.0},{"id":"https://openalex.org/C105795698","wikidata":"https://www.wikidata.org/wiki/Q12483","display_name":"Statistics","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1039/c1sm05264k","doi":"https://doi.org/10.1039/c1sm05264k","is_oa":false,"landing_page_url":"https://doi.org/10.1039/c1sm05264k","pdf_url":null,"source":{"id":"https://openalex.org/S6377669","display_name":"Soft Matter","issn_l":"1744-683X","issn":["1744-683X","1744-6848"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","dongbi-b","jufo-2","medline","norway-2","poland-100","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320556","host_organization_name":"Royal Society of Chemistry","host_organization_lineage":["https://openalex.org/P4310320556"],"host_organization_lineage_names":["Royal Society of Chemistry"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Soft Matter","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":76,"referenced_works":["https://openalex.org/W1554078579","https://openalex.org/W1964481380","https://openalex.org/W1965349716","https://openalex.org/W1966974228","https://openalex.org/W1968897789","https://openalex.org/W1968922205","https://openalex.org/W1971106383","https://openalex.org/W1973060079","https://openalex.org/W1975768071","https://openalex.org/W1977808549","https://openalex.org/W1978300990","https://openalex.org/W1979841560","https://openalex.org/W1983827953","https://openalex.org/W1987733093","https://openalex.org/W1988217789","https://openalex.org/W1989525899","https://openalex.org/W1989554368","https://openalex.org/W1992744334","https://openalex.org/W2002270176","https://openalex.org/W2005245447","https://openalex.org/W2006345232","https://openalex.org/W2008039399","https://openalex.org/W2008483108","https://openalex.org/W2011340557","https://openalex.org/W2014365905","https://openalex.org/W2017984976","https://openalex.org/W2019481323","https://openalex.org/W2022596716","https://openalex.org/W2024714327","https://openalex.org/W2028091603","https://openalex.org/W2029950035","https://openalex.org/W2029987677","https://openalex.org/W2031475041","https://openalex.org/W2031600034","https://openalex.org/W2035819916","https://openalex.org/W2035955622","https://openalex.org/W2040715635","https://openalex.org/W2040784316","https://openalex.org/W2044384478","https://openalex.org/W2044466713","https://openalex.org/W2050057010","https://openalex.org/W2051738771","https://openalex.org/W2052327379","https://openalex.org/W2058827055","https://openalex.org/W2061952589","https://openalex.org/W2062075942","https://openalex.org/W2062080953","https://openalex.org/W2063393943","https://openalex.org/W2066567158","https://openalex.org/W2071554034","https://openalex.org/W2072476846","https://openalex.org/W2072955637","https://openalex.org/W2073469217","https://openalex.org/W2077403422","https://openalex.org/W2078511462","https://openalex.org/W2082098811","https://openalex.org/W2083891026","https://openalex.org/W2085385386","https://openalex.org/W2086269990","https://openalex.org/W2087690577","https://openalex.org/W2089676705","https://openalex.org/W2090323475","https://openalex.org/W2112121708","https://openalex.org/W2113199756","https://openalex.org/W2113404900","https://openalex.org/W2116654205","https://openalex.org/W2118941217","https://openalex.org/W2120863222","https://openalex.org/W2128869577","https://openalex.org/W2137413193","https://openalex.org/W2137643105","https://openalex.org/W2140595006","https://openalex.org/W2141589769","https://openalex.org/W3125215701","https://openalex.org/W4240210254","https://openalex.org/W4241862909"],"related_works":["https://openalex.org/W2912703942","https://openalex.org/W2977831288","https://openalex.org/W2256623292","https://openalex.org/W2091409473","https://openalex.org/W2920715333","https://openalex.org/W3005633035","https://openalex.org/W7128007395","https://openalex.org/W1973238641","https://openalex.org/W2008483108","https://openalex.org/W2006332384"],"abstract_inverted_index":{"Polymeric":[0],"nanogels":[1],"undergo":[2],"large":[3],"reversible":[4],"volume":[5,132],"changes":[6,9],"with":[7,47],"moderate":[8],"in":[10,30],"environmental":[11],"conditions.":[12],"We":[13,114],"report":[14],"the":[15,58,64,70,77,96,110,116,131],"results":[16,97],"of":[17,25,42,73,83,94,100,112,118,120,127,136],"a":[18,26,31,39,106],"theoretically":[19],"informed":[20],"coarse-grained":[21,48],"Monte":[22],"Carlo":[23],"simulation":[24],"polymeric":[27],"nanogel":[28,35],"placed":[29],"solvent":[32,122],"bath.":[33],"The":[34,52],"is":[36,90],"modelled":[37],"as":[38],"regular":[40],"network":[41],"Gaussian":[43],"strands,":[44],"each":[45],"discretized":[46],"polymer":[49,128],"beads":[50],"(\u201cparticles\u201d).":[51],"non-bonded":[53],"interactions":[54],"are":[55,98],"evaluated":[56],"from":[57],"local":[59],"densities":[60],"(\u201cfields\u201d),":[61],"and":[62,76,102,124],"include":[63],"Flory-like":[65],"contribution":[66],"for":[67,92],"polymer-solvent":[68],"interactions,":[69],"translational":[71],"entropy":[72],"mobile":[74],"ions,":[75],"Coulomb":[78],"energy":[79],"obtained":[80],"by":[81,109],"solution":[82],"Poisson's":[84],"equation.":[85],"While":[86],"an":[87],"artificial":[88],"grid":[89,103],"employed":[91],"convenience":[93],"implementation,":[95],"independent":[99],"contour":[101],"discretization":[104],"within":[105],"resolution":[107],"specified":[108],"level":[111],"coarse-graining.":[113],"analyze":[115],"effects":[117],"degree":[119],"crosslinking,":[121],"quality,":[123],"charge":[125],"fraction":[126],"backbone,":[129],"on":[130],"phase":[133],"transition":[134],"behavior":[135],"nanogels.":[137]},"counts_by_year":[{"year":2026,"cited_by_count":2},{"year":2025,"cited_by_count":3},{"year":2024,"cited_by_count":1},{"year":2023,"cited_by_count":4},{"year":2022,"cited_by_count":2},{"year":2021,"cited_by_count":4},{"year":2020,"cited_by_count":10},{"year":2019,"cited_by_count":9},{"year":2018,"cited_by_count":9},{"year":2017,"cited_by_count":8},{"year":2016,"cited_by_count":10},{"year":2015,"cited_by_count":5},{"year":2014,"cited_by_count":5},{"year":2013,"cited_by_count":5},{"year":2012,"cited_by_count":4}],"updated_date":"2026-10-16T09:59:22.235173","created_date":"2016-06-24T00:00:00"}