Constant-pH molecular dynamics study of protonation-structure relationship in a heptapeptide derived from ovomucoid third domain

Physical Review E - Statistical, Nonlinear, and Soft Matter Physics

Volumn 69, Issue 2 1, 2004, Pages

  Długosz, Maciej ^a   Antosiewicz, Jan M ^a   Robertson, Andrew D ^b  

^a UNIVERSITY OF WARSAW   (Poland)

^b UNIVERSITY OF IOWA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ACETYLATION; ALGORITHMS; COMPUTER SIMULATION; CONFORMATIONS; IONIC STRENGTH; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; MONTE CARLO METHODS; NUCLEAR MAGNETIC RESONANCE; PERMITTIVITY; PH EFFECTS; PROTEINS; SOLVENTS; TITRATION;

HEPTAPEPTIDES; MOLECULAR DYNAMICS (MD) SIMULATIONS; PROTONATION; PROTONATION-STRUCTURES;

POLYPEPTIDES;

EID: 42749101264     PISSN: 1063651X     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevE.69.021915     Document Type: Article

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