Building a model of the blue cone pigment based on the wild type rhodopsin structure with QM/MM methods

Journal of Physical Chemistry B

Volumn 116, Issue 10, 2012, Pages 3313-3321

  Frähmcke, Jan S ^a   Wanko, Marius ^b   Elstner, Marcus ^a,c  

^a TECHNICAL UNIVERSITY OF BRAUNSCHWEIG   (Germany)

^b UNIVERSITY OF THE BASQUE COUNTRY UPV EHU   (Spain)

^c KARLSRUHE INSTITUTE OF TECHNOLOGY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

AMINO ACIDS; CHROMOPHORES; MODEL STRUCTURES; MOLECULAR DYNAMICS; MOLECULAR MODELING; X RAY CRYSTALLOGRAPHY;

AB INITIO; BLUE-SHIFTED; BOVINE RHODOPSIN; COLOR TUNING; ELECTROSTATIC EFFECT; GENETIC FACTORS; GENETIC ORIGIN; HOMOLOGY MODELS; HOST PROTEINS; MOLECULAR DYNAMICS SIMULATIONS; MULTI REFERENCE; QM/MM METHOD; SEMI-EMPIRICAL; STRUCTURAL EFFECT; STRUCTURAL MODELS; STRUCTURAL ORIGIN; THEORETICAL STUDY; UV-VIS ABSORPTIONS; WILD TYPES; X-RAY CRYSTALLOGRAPHIC STRUCTURES;

ALDEHYDES;

EID: 84858313354     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp2086472     Document Type: Article

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