Web interface for brownian dynamics simulation of ion transport and its applications to beta-barrel pores

Journal of Computational Chemistry

Volumn 33, Issue 3, 2012, Pages 331-339

  Lee, Kyu Il ^a   Jo, Sunhwan ^a   Rui, Huan ^a   Egwolf, Bernhard ^b   Roux, Benoît ^c   Pastor, Richard W ^d   Im, Wonpil ^a  

^a UNIVERSITY OF KANSAS   (United States)

^b MAX PLANCK INSTITUTE FOR BIOPHYSICAL CHEMISTRY   (Germany)

^c UNIVERSITY OF CHICAGO   (United States)

^d NATIONAL HEART LUNG AND BLOOD INSTITUTE   (United States)

Author keywords

hemolysin; anthrax toxin protective antigen pore; channel conductance; grand canonical Monte Carlo Brownian dynamics; ion selectivity; voltage dependent anion channel

Indexed keywords

ANTHRAX TOXINS; CHANNEL CONDUCTANCE; GRAND CANONICAL MONTE CARLO; ION SELECTIVITY; VOLTAGE DEPENDENT ANION CHANNEL;

ANTIGENS; BIOELECTRIC POTENTIALS; BLOOD; BROWNIAN MOVEMENT; CHLORINE COMPOUNDS; COMPUTER SIMULATION; DIFFUSION; DISEASES; DYNAMICS; GRAPHICAL USER INTERFACES; MOLECULAR DYNAMICS; PROTEINS; WEBSITES;

IONS;

ANTHRAX TOXIN; BACTERIAL ANTIGEN; BACTERIAL TOXIN; HEMOLYSIN;

ARTICLE; CHEMISTRY; COMPUTER INTERFACE; IMMUNOLOGY; INTERNET; ION TRANSPORT;

ANTIGENS, BACTERIAL; BACTERIAL TOXINS; HEMOLYSIN PROTEINS; INTERNET; ION TRANSPORT; USER-COMPUTER INTERFACE;

EID: 83855161665     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.21952     Document Type: Article

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