Dynamics of disulfide-bond disruption and formation in the thermal unfolding of ribonuclease A

Paweł Krupa , Adam Sieradzan , Magdalena A. Mozolewska , Huiyu Li , Józef Adam Liwo , Harold A. Scheraga

Abstract

n/a
Author Paweł Krupa
Paweł Krupa,,
-
, Adam Sieradzan (FCh / DTCh / LMM)
Adam Sieradzan,,
- Laboratory of Molecular Modeling
, Magdalena A. Mozolewska
Magdalena A. Mozolewska,,
-
, Huiyu Li
Huiyu Li,,
-
, Józef Adam Liwo (FCh / DTCh / LMM)
Józef Adam Liwo,,
- Laboratory of Molecular Modeling
, Harold A. Scheraga
Harold A. Scheraga,,
-
Journal seriesJournal of Chemical Theory and Computation, ISSN 1549-9618, (A 40 pkt)
Issue year2017
Vol13
No11
Pages5721-5730
Publication size in sheets0.5
Keywords in Englishbovine pancreatic ribonuclease, unres force-field, local conformational states, united-residue model, molecular-dynamics, replica-exchange, temperature-dependence, proline isomerization, polypeptide-chains, denatured states
ASJC Classification1606 Physical and Theoretical Chemistry; 1706 Computer Science Applications
DOIDOI:10.1021/acs.jctc.7b00724
URL http://pubs.acs.org/doi/pdf/10.1021/acs.jctc.7b00724
Languageen angielski
Score (nominal)40
ScoreMinisterial score = 40.0, ArticleFromJournal
Ministerial score (2013-2016) = 40.0, ArticleFromJournal
Publication indicators WoS Citations = 1; Scopus SNIP (Source Normalised Impact per Paper): 2017 = 1.476; WoS Impact Factor: 2017 = 5.399 (2) - 2017=5.793 (5)
Citation count*1 (2019-04-17)
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* presented citation count is obtained through Internet information analysis and it is close to the number calculated by the Publish or Perish system.
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