{ "labelLang" : "hun", "responseDate" : "2024-03-28 15:00", "content" : { "otype" : "JournalArticle", "mtid" : 2386703, "status" : "ADMIN_APPROVED", "published" : true, "comment" : "Cited By :2 \n Export Date: 12 October 2022 \n CODEN: CHPLB \n Correspondence Address: Knak Jensen, S.J.; Department of Chemistry, 140 Langelandsgade, DK-8000 Aarhus C, Denmark; email: kemskj@chem.au.dk", "unhandledTickets" : 0, "oldTimestamp" : "2018-09-25T21:18:32.000+0000", "deleted" : false, "oldId" : 2386703, "lastRefresh" : "2024-03-27T12:12:22.389+0000", "lastModified" : "2020-12-22T12:38:33.228+0000", "created" : "2013-08-29T13:54:57.000+0000", "creator" : { "otype" : "Admin", "mtid" : 10020539, "link" : "/api/admin/10020539", "label" : "Hegyi Judit (ELTE TTK Kari Adm - INAKTÍV, admin)", "familyName" : "Hegyi", "givenName" : "Judit", "published" : true, "oldId" : 10020539, "snippet" : true }, "lastDuplumSearch" : "2024-03-27T12:09:45.055+0000", "adminApproved" : "2020-02-07T10:22:29.188+0000", "adminApprover" : { "otype" : "Admin", "mtid" : 10065569, "link" : "/api/admin/10065569", "label" : "Pécsi Éva (MTMT Közp 3, admin)", "familyName" : "Pécsi", "givenName" : "Éva", "published" : true, "snippet" : true }, "core" : true, "citation" : true, "publicationPending" : false, "type" : { "otype" : "PublicationType", "mtid" : 24, "link" : "/api/publicationtype/24", "label" : "Folyóiratcikk", "code" : 24, "otypeName" : "JournalArticle", "listPosition" : 1, "published" : true, "oldId" : 24, "snippet" : true }, "subType" : { "otype" : "SubType", "mtid" : 10000059, "link" : "/api/subtype/10000059", "label" : "Szakcikk (Folyóiratcikk)", "name" : "Szakcikk", "nameEng" : "Article", "docType" : { "otype" : "PublicationType", "mtid" : 24, "link" : "/api/publicationtype/24", "label" : "Folyóiratcikk", "code" : 24, "otypeName" : "JournalArticle", "listPosition" : 1, "published" : true, "oldId" : 24, "snippet" : true }, "listPosition" : 101, "published" : true, "oldId" : 10000059, "snippet" : true }, "category" : { "otype" : "Category", "mtid" : 1, "link" : "/api/category/1", "label" : "Tudományos", "published" : true, "oldId" : 1, "snippet" : true }, "languages" : [ { "otype" : "Language", "mtid" : 10002, "link" : "/api/language/10002", "label" : "Angol", "name" : "Angol", "nameEng" : "English", "published" : true, "oldId" : 2, "snippet" : true } ], "firstAuthor" : "Jákli, I", "authorships" : [ { "otype" : "PersonAuthorship", "mtid" : 4319507, "link" : "/api/authorship/4319507", "label" : "Jákli, I [Jákli, Imre (Kémia), szerző] MTA-ELTE Fehérjemodellező Kutatócsoport (ELTE / TTK / KI)", "listPosition" : 1, "share" : 0.14285715, "first" : true, "last" : false, "author" : { "otype" : "Author", "mtid" : 10019938, "link" : "/api/author/10019938", "label" : "Jákli Imre (Kémia)", "familyName" : "Jákli", "givenName" : "Imre", "published" : true, "oldId" : 10019938, "snippet" : true }, "familyName" : "Jákli", "givenName" : "I", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662310, "snippet" : true }, { "otype" : "PersonAuthorship", "mtid" : 4319508, "link" : "/api/authorship/4319508", "label" : "Csizmadia, IG [Csizmadia, Imre Gyula (számítógépes kémia), szerző] Kémiai Informatika Tanszék (SZTE / JGYPK / ATTI)", "listPosition" : 2, "share" : 0.14285715, "first" : false, "last" : false, "author" : { "otype" : "Author", "mtid" : 10011269, "link" : "/api/author/10011269", "label" : "Csizmadia Imre Gyula (számítógépes kémia)", "familyName" : "Csizmadia", "givenName" : "Imre Gyula", "published" : true, "oldId" : 10011269, "snippet" : true }, "familyName" : "Csizmadia", "givenName" : "IG", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662309, "snippet" : true }, { "otype" : "PersonAuthorship", "mtid" : 4319509, "link" : "/api/authorship/4319509", "label" : "Fejer, SN [Fejér, Szilárd (Kémiai tudományok), szerző] Kémiai Informatika Tanszék (SZTE / JGYPK / ATTI)", "listPosition" : 3, "share" : 0.14285715, "first" : false, "last" : false, "author" : { "otype" : "Author", "mtid" : 10040796, "link" : "/api/author/10040796", "label" : "Fejér Szilárd (Kémiai tudományok)", "familyName" : "Fejér", "givenName" : "Szilárd", "published" : true, "oldId" : 10040796, "snippet" : true }, "familyName" : "Fejer", "givenName" : "SN", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662308, "snippet" : true }, { "otype" : "PersonAuthorship", "mtid" : 4319510, "link" : "/api/authorship/4319510", "label" : "Farkas, Ö [Farkas, Ödön (Elméleti szerves ...), szerző] Kémiai Informatikai Laboratórium (KIL) (ELTE / TTK / KI)", "listPosition" : 4, "share" : 0.14285715, "first" : false, "last" : false, "author" : { "otype" : "Author", "mtid" : 10003012, "link" : "/api/author/10003012", "label" : "Farkas Ödön (Elméleti szerves kémia)", "familyName" : "Farkas", "givenName" : "Ödön", "published" : true, "oldId" : 10003012, "snippet" : true }, "familyName" : "Farkas", "givenName" : "Ö", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662307, "snippet" : true }, { "otype" : "PersonAuthorship", "mtid" : 4319511, "link" : "/api/authorship/4319511", "label" : "Viskolcz, B [Viskolcz, Béla (Anyagtudomány és ...), szerző] Kémiai Informatika Tanszék (SZTE / JGYPK / ATTI)", "listPosition" : 5, "share" : 0.14285715, "first" : false, "last" : false, "author" : { "otype" : "Author", "mtid" : 10023051, "link" : "/api/author/10023051", "label" : "Viskolcz Béla (Anyagtudomány és technológia)", "familyName" : "Viskolcz", "givenName" : "Béla", "published" : true, "oldId" : 10023051, "snippet" : true }, "familyName" : "Viskolcz", "givenName" : "B", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662306, "snippet" : true }, { "otype" : "PersonAuthorship", "mtid" : 4319512, "link" : "/api/authorship/4319512", "label" : "Knak, Jensen SJ", "listPosition" : 6, "share" : 0.14285715, "first" : false, "last" : false, "familyName" : "Knak", "givenName" : "Jensen SJ", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662305, "snippet" : true }, { "otype" : "PersonAuthorship", "mtid" : 4319513, "link" : "/api/authorship/4319513", "label" : "Perczel, A [Perczel, András (Peptidek és fehér...), szerző] Szerkezeti Kémiai és Biológiai Laboratórium (Sz... (ELTE / TTK / KI)", "listPosition" : 7, "share" : 0.14285715, "first" : false, "last" : true, "author" : { "otype" : "Author", "mtid" : 1062306, "link" : "/api/author/1062306", "label" : "Perczel András (Peptidek és fehérjék szerkezetkutatása)", "familyName" : "Perczel", "givenName" : "András", "published" : true, "oldId" : 1062306, "snippet" : true }, "familyName" : "Perczel", "givenName" : "A", "authorTyped" : true, "editorTyped" : false, "otherTyped" : false, "type" : { "otype" : "AuthorshipType", "mtid" : 1, "link" : "/api/authorshiptype/1", "label" : "Szerző", "code" : 0, "published" : true, "oldId" : 0, "snippet" : true }, "published" : false, "oldId" : 18662304, "snippet" : true } ], "title" : "Helix compactness and stability: Electron structure calculations of conformer dependent thermodynamic functions", "identifiers" : [ { "otype" : "PublicationIdentifier", "mtid" : 701402, "link" : "/api/publicationidentifier/701402", "label" : "DOI: 10.1016/j.cplett.2013.01.060", "source" : { "otype" : "PlainSource", "mtid" : 6, "link" : "/api/publicationsource/6", "label" : "DOI", "type" : { "otype" : "PublicationSourceType", "mtid" : 10001, "link" : "/api/publicationsourcetype/10001", "label" : "DOI", "mayHaveOa" : true, "published" : true, "snippet" : true }, "name" : "DOI", "nameEng" : "DOI", "linkPattern" : "https://doi.org/@@@", "publiclyVisible" : true, "published" : true, "oldId" : 6, "snippet" : true }, "oaFree" : false, "validState" : "IDENTICAL", "idValue" : "10.1016/j.cplett.2013.01.060", "realUrl" : "https://doi.org/10.1016/j.cplett.2013.01.060", "published" : false, "oldId" : 481700, "snippet" : true }, { "otype" : "PublicationIdentifier", "mtid" : 24380348, "link" : "/api/publicationidentifier/24380348", "label" : "ISSN: 1873-4448", "source" : { "otype" : "PlainSource", "mtid" : 123, "link" : "/api/publicationsource/123", "label" : "ISSN", "type" : { "otype" : "PublicationSourceType", "mtid" : 10002, "link" : "/api/publicationsourcetype/10002", "label" : "Egyéb", "mayHaveOa" : false, "published" : true, "snippet" : true }, "name" : "ISSN", "nameEng" : "ISSN", "linkPattern" : "https://portal.issn.org/resource/ISSN/@@@", "publiclyVisible" : true, "published" : true, "oldId" : 123, "snippet" : true }, "oaType" : "NONE", "validState" : "IDENTICAL", "idValue" : "1873-4448", "realUrl" : "https://portal.issn.org/resource/ISSN/1873-4448", "published" : false, "snippet" : true }, { "otype" : "PublicationIdentifier", "mtid" : 701403, "link" : "/api/publicationidentifier/701403", "label" : "REAL: 9023", "source" : { "otype" : "SwordSource", "mtid" : 36, "link" : "/api/publicationsource/36", "label" : "REAL", "type" : { "otype" : "PublicationSourceType", "mtid" : 10007, "link" : "/api/publicationsourcetype/10007", "label" : "Repozitórium", "mayHaveOa" : true, "published" : true, "snippet" : true }, "name" : "REAL", "nameEng" : "REAL", "linkPattern" : "http://real.mtak.hu/@@@", "publiclyVisible" : true, "published" : true, "oldId" : 36, "snippet" : true }, "oaFree" : false, "validState" : "NO", "idValue" : "9023", "realUrl" : "http://real.mtak.hu/9023", "published" : false, "oldId" : 685393, "snippet" : true }, { "otype" : "PublicationIdentifier", "mtid" : 701400, "link" : "/api/publicationidentifier/701400", "label" : "WoS: 000315797700015", "source" : { "otype" : "PlainSource", "mtid" : 1, "link" : "/api/publicationsource/1", "label" : "WoS", "type" : { "otype" : "PublicationSourceType", "mtid" : 10003, "link" : "/api/publicationsourcetype/10003", "label" : "Indexelő adatbázis", "mayHaveOa" : false, "published" : true, "snippet" : true }, "name" : "WoS", "nameEng" : "WoS", "linkPattern" : "https://www.webofscience.com/wos/woscc/full-record/@@@", "publiclyVisible" : true, "published" : true, "oldId" : 1, "snippet" : true }, "oaFree" : false, "validState" : "IDENTICAL", "idValue" : "000315797700015", "realUrl" : "https://www.webofscience.com/wos/woscc/full-record/000315797700015", "published" : false, "oldId" : 573247, "snippet" : true }, { "otype" : "PublicationIdentifier", "mtid" : 701401, "link" : "/api/publicationidentifier/701401", "label" : "Scopus: 84874941785", "source" : { "otype" : "PlainSource", "mtid" : 3, "link" : "/api/publicationsource/3", "label" : "Scopus", "type" : { "otype" : "PublicationSourceType", "mtid" : 10003, "link" : "/api/publicationsourcetype/10003", "label" : "Indexelő adatbázis", "mayHaveOa" : false, "published" : true, "snippet" : true }, "name" : "Scopus", "linkPattern" : "http://www.scopus.com/record/display.url?origin=inward&eid=2-s2.0-@@@", "publiclyVisible" : true, "published" : true, "oldId" : 3, "snippet" : true }, "oaFree" : false, "validState" : "IDENTICAL", "idValue" : "84874941785", "realUrl" : "http://www.scopus.com/record/display.url?origin=inward&eid=2-s2.0-84874941785", "published" : false, "oldId" : 481699, "snippet" : true } ], "journal" : { "otype" : "Journal", "mtid" : 985, "link" : "/api/journal/985", "label" : "CHEMICAL PHYSICS LETTERS 0009-2614 1873-4448", "pIssn" : "0009-2614", "eIssn" : "1873-4448", "reviewType" : "REVIEWED", "noIF" : false, "sciIndexed" : true, "scopusIndexed" : true, "lang" : "FOREIGN", "hungarian" : false, "published" : true, "oldId" : 985, "snippet" : true }, "volume" : "563", "firstPage" : "80", "lastPage" : "87", "firstPageOrInternalIdForSort" : "80", "pageLength" : 8, "publishedYear" : 2013, "abstractText" : "Structure, stability, cooperativity and molecular packing of two major backbone forms: 310-helix and β-strand are investigated. Long models HCO-(Xxx)n-NH2 Xxx = Gly and (l-)Ala, n ≤ 34, are studied at two levels of theory including the effect of dispersion forces. Structure and folding preferences are established, the length modulated cooperativity and side-chain determined fold compactness is quantified. By monitoring ΔG°β→α rather than the electronic energy, ΔEβ→α, it appears that Ala is a much better helix forming residue than Gly. The achiral Gly forms a more compact 310-helix than any chiral amino acid residue probed here for l-Ala.", "subjects" : [ { "otype" : "Classification", "mtid" : 10154, "link" : "/api/classification/10154", "label" : "Fizika", "published" : true, "snippet" : true } ], "keywords" : [ { "otype" : "Keyword", "mtid" : 839, "link" : "/api/keyword/839", "label" : "COOPERATIVITY", "published" : true, "oldId" : 839, "snippet" : true }, { "otype" : "Keyword", "mtid" : 2984, "link" : "/api/keyword/2984", "label" : "SIDE-CHAINS", "published" : true, "oldId" : 2984, "snippet" : true }, { "otype" : "Keyword", "mtid" : 17664, "link" : "/api/keyword/17664", "label" : "amino acids", "published" : true, "oldId" : 17664, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1000637, "link" : "/api/keyword/1000637", "label" : "THERMODYNAMIC FUNCTIONS", "published" : true, "oldId" : 1000637, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1018244, "link" : "/api/keyword/1018244", "label" : "Structure (composition)", "published" : true, "oldId" : 1018244, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1219409, "link" : "/api/keyword/1219409", "label" : "Dispersion force", "published" : true, "oldId" : 1219409, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1261180, "link" : "/api/keyword/1261180", "label" : "Molecular packings", "published" : true, "oldId" : 1261180, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1261181, "link" : "/api/keyword/1261181", "label" : "Electronic energies", "published" : true, "oldId" : 1261181, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1261182, "link" : "/api/keyword/1261182", "label" : "Electron structures", "published" : true, "oldId" : 1261182, "snippet" : true }, { "otype" : "Keyword", "mtid" : 1261183, "link" : "/api/keyword/1261183", "label" : "Chiral amino acids", "published" : true, "oldId" : 1261183, "snippet" : true } ], "digital" : null, "printed" : null, "sourceYear" : 2013, "packet" : "663507", "foreignEdition" : true, "foreignLanguage" : true, "fullPublication" : true, "conferencePublication" : false, "nationalOrigin" : true, "missingAuthor" : false, "oaType" : "NONE", "oaCheckDate" : "2024-03-27", "oaFree" : false, "oaByAuthor" : { "otype" : "Admin", "mtid" : 10003132, "link" : "/api/admin/10003132", "label" : "Balázs András (MTMT Központ, admin)", "familyName" : "Balázs", "givenName" : "András", "published" : true, "oldId" : 10003132, "snippet" : true }, "citationCount" : 2, "citationCountUnpublished" : 0, "citationCountWoOther" : 2, "independentCitCountWoOther" : 1, "nationalOriginCitationCount" : 1, "foreignEditionCitationCount" : 2, "doiCitationCount" : 2, "wosCitationCount" : 1, "scopusCitationCount" : 2, "wosScopusCitationCount" : 2, "wosScopusCitationCountWoOther" : 2, "wosScopusIndependentCitationCount" : 1, "wosScopusIndependentCitationCountWoOther" : 1, "independentCitationCount" : 1, "selfCitationCount" : 1, "unhandledCitationCount" : 0, "citingPubCount" : 2, "independentCitingPubCount" : 1, "citingPubCountWoOther" : 2, "independentCitingPubCountWoOther" : 1, "unhandledCitingPubCount" : 0, "citedPubCount" : 16, "citedCount" : 16, "pubStats" : { "types" : [ { "type" : "Folyóiratcikk", "typeEng" : "Journal Article", "code" : 24, "count" : 1 }, { "type" : "Könyvrészlet", "typeEng" : "Chapter in Book", "code" : 25, "count" : 1 }, { "type" : "Könyv", "typeEng" : "Book", "code" : 23, "count" : 0 }, { "type" : "Egyéb konferenciaközlemény", "typeEng" : "Conference paper", "code" : 31, "count" : 0 }, { "type" : "Egyéb konferenciakötet", "typeEng" : "Conference proceedings", "code" : 32, "count" : 0 }, { "type" : "Oltalmi formák", "typeEng" : "Protection forms", "code" : 26, "count" : 0 }, { "type" : "Disszertáció", "typeEng" : "Thesis", "code" : 28, "count" : 0 }, { "type" : "Egyéb", "typeEng" : "Miscellaneous", "code" : 29, "count" : 0 }, { "type" : "Alkotás", "typeEng" : "Achievement", "code" : 22, "count" : 0 }, { "type" : "Kutatási adat", "typeEng" : "Research data", "code" : 33, "count" : 0 } ], "citationTypes" : [ { "type" : "Folyóiratcikk", "typeEng" : "Journal Article", "code" : 24, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Könyvrészlet", "typeEng" : "Chapter in Book", "code" : 25, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Könyv", "typeEng" : "Book", "code" : 23, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Egyéb konferenciaközlemény", "typeEng" : "Conference paper", "code" : 31, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Egyéb konferenciakötet", "typeEng" : "Conference proceedings", "code" : 32, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Oltalmi formák", "typeEng" : "Protection forms", "code" : 26, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Disszertáció", "typeEng" : "Thesis", "code" : 28, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Egyéb", "typeEng" : "Miscellaneous", "code" : 29, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Alkotás", "typeEng" : "Achievement", "code" : 22, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 }, { "type" : "Kutatási adat", "typeEng" : "Research data", "code" : 33, "countUnknown" : 0, "countIndependent" : 0, "countSelfCitation" : 0 } ], "years" : [ { "year" : 2014, "publicationCount" : 0, "citationCount" : 1, "independentCitationCount" : 0, "citingPubCount" : 1, "independentCitingPubCount" : 0, "oaStats" : null, "oaStats2" : null }, { "year" : 2015, "publicationCount" : 0, "citationCount" : 0, "independentCitationCount" : 0, "citingPubCount" : 0, "independentCitingPubCount" : 0, "oaStats" : null, "oaStats2" : null }, { "year" : 2016, "publicationCount" : 0, "citationCount" : 1, "independentCitationCount" : 1, "citingPubCount" : 1, "independentCitingPubCount" : 1, "oaStats" : null, "oaStats2" : null } ] }, "ratings" : [ { "otype" : "SjrRating", "mtid" : 11156066, "link" : "/api/sjrrating/11156066", "label" : "sjr:Q2 (2013) Scopus - Physical and Theoretical Chemistry CHEMICAL PHYSICS LETTERS 0009-2614", "listPos" : 50, "rankValue" : 0.49, "type" : "journal", "ratingType" : { "otype" : "RatingType", "mtid" : 10002, "link" : "/api/ratingtype/10002", "label" : "sjr", "code" : "sjr", "published" : true, "snippet" : true }, "subject" : { "otype" : "ClassificationExternal", "mtid" : 1606, "link" : "/api/classificationexternal/1606", "label" : "Scopus - Physical and Theoretical Chemistry", "published" : true, "oldId" : 1606, "snippet" : true }, "ranking" : "Q2", "calculation" : "DIRECT", "published" : true, "snippet" : true } ], "ratingsForSort" : "Q2", "references" : [ { "otype" : "Reference", "mtid" : 1711356, "link" : "/api/reference/1711356", "label" : "1. Liljas, A., Liljas, L., Piskur, J., Lindblom, G., Nissen, P., Kjeldgaard, M., (2009) Textbook of Structural Biology, , World Scientific, Publishing Co. Pte. Ltd. Singapore", "listPosition" : 1, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711357, "link" : "/api/reference/1711357", "label" : "2. Topol, I.A., Burt, S.K., Deretey, E., Tang, T.-H., Perczel, A., Rashin, A., Csizmadia, I.G., (2001) J. Am. Chem. Soc., 123, p. 6054", "listPosition" : 2, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711358, "link" : "/api/reference/1711358", "label" : "3. Perczel, A., Ángyán, J.G., Kajtár, M., Viviani, W., Rivail, J.L., Marcoccia, J.F., Csizmadia, I.G., (1991) J. Am. Chem. Soc., 113, p. 6256", "listPosition" : 3, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711359, "link" : "/api/reference/1711359", "label" : "4. Oregano, C.A., Michie, A.D., Jones, S., Jones, D.T., Swindells, M.B., Thornton, J.M., (1997) Structure, 5, p. 1093", "listPosition" : 4, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711360, "link" : "/api/reference/1711360", "label" : "5. Tompa, P., (2009) Structure and Function of Intrinsically Disordered Proteins, , Chapman and Hall/CRC", "listPosition" : 5, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711361, "link" : "/api/reference/1711361", "label" : "6. Kiss, R., Kovács, D., Tompa, P., Perczel, A., (2008) Biochemistry, 47, p. 6936", "listPosition" : 6, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711362, "link" : "/api/reference/1711362", "label" : "7. Craig, R., Woodhead, J.L., (2006) Curr. Opin. Struct. Biol., 16, p. 204", "listPosition" : 7, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711363, "link" : "/api/reference/1711363", "label" : "8. Yang, Y., (2007) Structure, 15, p. 553", "listPosition" : 8, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711364, "link" : "/api/reference/1711364", "label" : "9. Kumar, S., Bansal, M., (1998) Biophys. J., 75, p. 1935", "listPosition" : 9, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711365, "link" : "/api/reference/1711365", "label" : "10. Hildebrand, P.W., Preissner, R., Frömmel, C., (2004) FEBS Lett., 559, p. 145", "listPosition" : 10, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711366, "link" : "/api/reference/1711366", "label" : "11. Lupas, A.N., Gruber, M., (2005) Adv. Protein Chem., 70, p. 37", "listPosition" : 11, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711367, "link" : "/api/reference/1711367", "label" : "12. Szappanos, B., Süveges, D., Nyitray, L., Perczel, A., Tóth, G., Gáspári, Z., (2010) FEBS J., 277, p. 257", "listPosition" : 12, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711368, "link" : "/api/reference/1711368", "label" : "13. Suveges, D., Gaspari, Z., Toth, G., Nyitray, L., (2009) Proteins, 74, p. 905", "listPosition" : 13, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711369, "link" : "/api/reference/1711369", "label" : "14. Kumar, S., Bansal, M., (1996) Biophys. J., 71, p. 1574", "listPosition" : 14, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711370, "link" : "/api/reference/1711370", "label" : "15. Perczel, A., Farkas, Ö., Csizmadia, I.G., (1995) J. Am. Chem. Soc., 117, p. 1653", "listPosition" : 15, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711371, "link" : "/api/reference/1711371", "label" : "16. Perczel, A., Jákli, I., Csizmadia, I.G., (2003) Chem. Eur. J., 9, p. 5332", "listPosition" : 16, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711372, "link" : "/api/reference/1711372", "label" : "17. Beke, T., Czajlik, A., Csizmadia, I.G., Perczel, A., (2006) Phys. Biol., 3, p. 26", "listPosition" : 17, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711373, "link" : "/api/reference/1711373", "label" : "18. Wieczorek, R., Dannenberg, J.J., (2003) J. Am. Chem. Soc., 125, p. 8124", "listPosition" : 18, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711374, "link" : "/api/reference/1711374", "label" : "19. Jagielska, A., Skolnick, J., (2007) J. Comput. Chem., 28, p. 164", "listPosition" : 19, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711375, "link" : "/api/reference/1711375", "label" : "20. Viskolcz, B., Fejer, S.N., Knak Jensen, S.J., Perczel, A., Csizmadia, I.G., (2007) Chem. Phys. Lett., 450, p. 123", "listPosition" : 20, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711376, "link" : "/api/reference/1711376", "label" : "21. Lopez-Llano, J., Campos, L.A., Sancho, J., (2006) Proteins, 64, p. 769", "listPosition" : 21, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711377, "link" : "/api/reference/1711377", "label" : "22. Frisch, M.J., Gaussian 09, , Revision A.02, Gaussian, Inc., Wallingford, CT, USA", "listPosition" : 22, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711378, "link" : "/api/reference/1711378", "label" : "23. Law, J.M.S., Setiadi, D.H., Chass, G.A., Csizmadia, I.G., Viskolcz, B., (2005) J. Phys. Chem. A, 109, p. 520", "listPosition" : 23, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711379, "link" : "/api/reference/1711379", "label" : "24. Law, J.M.S., Szori, M., Izsak, R., Penke, B., Csizmadia, I.G., Viskolcz, B., (2006) J. Phys. Chem. A, 110, p. 6100", "listPosition" : 24, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711380, "link" : "/api/reference/1711380", "label" : "25. Jójárt, B., Martinek, T.A., (2007) J. Comput. Chem., 28, p. 2051", "listPosition" : 25, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711381, "link" : "/api/reference/1711381", "label" : "26. Wan, S., Stote, R.H., Karplus, M., (2004) J. Chem. Phys., 121, p. 9539", "listPosition" : 26, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711382, "link" : "/api/reference/1711382", "label" : "27. Meirovitch, H., (2007) Curr. Opin. Struct. Biol., 17, p. 181", "listPosition" : 27, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711383, "link" : "/api/reference/1711383", "label" : "28. Perczel, A., Hudáky, P., Pálfi, V.K., (2007) J. Am. Chem. Soc., 129, p. 14959", "listPosition" : 28, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711384, "link" : "/api/reference/1711384", "label" : "29. Wang, J., Kim, S., Kovacs, F., Cross, T.A., (2001) Protein Sci., 10, p. 2241", "listPosition" : 29, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711385, "link" : "/api/reference/1711385", "label" : "30. Kim, S., Cross, T.A., (2002) Biophys. J., 83, p. 2084", "listPosition" : 30, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711386, "link" : "/api/reference/1711386", "label" : "31. Paga, R.C., Kim, S., Cross, T.A., (2008) Structure, 16, p. 787", "listPosition" : 31, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711387, "link" : "/api/reference/1711387", "label" : "32. Smith, L.J., Bolin, K.A., Schwalbe, H., MacArthur, M.W., Thornton, J.M., Dobson, C.M., (1996) J. Mol. Biol., 255, p. 494", "listPosition" : 32, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711388, "link" : "/api/reference/1711388", "label" : "33. Enkhbayar, P., Hikichi, K., Osaki, M., Kretsinger, R.H., Matsushima, N., (2006) Proteins, 64, p. 691", "listPosition" : 33, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711389, "link" : "/api/reference/1711389", "label" : "34. Pohl, G., Perczel, A., Vass, E., Magyarfalvi, G., Tarczay, G., (2007) Phys. Chem. Chem. Phys., 9, p. 4698", "listPosition" : 34, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711390, "link" : "/api/reference/1711390", "label" : "35. (2004) Handbook of Chemistry and Physics, pp. 9-47. , 85th edn., CRC Press, Boca Raton, Fl, USA", "listPosition" : 35, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711391, "link" : "/api/reference/1711391", "label" : "36. Viskolcz, B., Csizmadia, I.G., Knak Jensen, S.J., Perczel, A., (2010) Chem. Phys. Lett., 501, p. 30", "listPosition" : 36, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711392, "link" : "/api/reference/1711392", "label" : "37. Grimme, S., Antony, J., Ehrlich, S., Krieg, H., (2010) J. Chem. Phys., 132, p. 154104", "listPosition" : 37, "published" : false, "snippet" : true }, { "otype" : "Reference", "mtid" : 1711393, "link" : "/api/reference/1711393", "label" : "38. Luque, I., Mayorga, O.L., Freire, E., (1996) Biochemistry, 35, p. 13681", "listPosition" : 38, "published" : false, "snippet" : true } ], "hasCitationDuplums" : false, "userChangeableUntil" : "2014-03-20T09:55:22.000+0000", "publishDate" : "2013-08-30T07:57:16.000+0000", "directInstitutesForSort" : "Kémiai Informatika Tanszék (SZTE / JGYPK / ATTI); Kémiai Informatikai Laboratórium (KIL) (ELTE / TTK / KI); MTA-ELTE Fehérjemodellező Kutatócsoport (ELTE / TTK / KI); Szerkezeti Kémiai és Biológiai Laboratórium (Sz... (ELTE / TTK / KI)", "ownerAuthorCount" : 6, "ownerInstituteCount" : 34, "directInstituteCount" : 4, "authorCount" : 7, "contributorCount" : 0, "hasQualityFactor" : true, "link" : "/api/publication/2386703", "label" : "Jákli I et al. Helix compactness and stability: Electron structure calculations of conformer dependent thermodynamic functions. (2013) CHEMICAL PHYSICS LETTERS 0009-2614 1873-4448 563 80-87", "template" : "