Distance geometry protocol to generate conformations of natural products to structurally interpret ion mobility-mass spectrometry collision cross sections

Journal of Physical Chemistry B

Volumn 118, Issue 48, 2014, Pages 13812-13820

  Stow, Sarah M ^a,b   Goodwin, Cody R ^a,b   Kliman, Michal ^a,b   Bachmann, Brian O ^a,b   McLean, J A ^a,b   Lybrand, Terry P ^a,b  

^a VANDERBILT UNIVERSITY   (United States)

^b VANDERBILT UNIVERSITY SCHOOL OF MEDICINE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BIOACTIVITY; BIOINFORMATICS; GEOMETRY; ION MOBILITY SPECTROMETERS; IONIZATION OF GASES; IONS; MASS SPECTROMETRY; MOLECULAR DYNAMICS; MOLECULES; PROTEINS;

COLLISION CROSS SECTIONS; COMPUTATIONALLY EFFICIENT; CONFORMATIONAL ANALYSIS; CONFORMATIONAL SAMPLINGS; ION MOBILITY-MASS SPECTROMETRY; ION-NEUTRAL COLLISIONS; MOLECULAR DYNAMICS SIMULATIONS; STRUCTURAL CHARACTERISTICS;

CONFORMATIONS;

BIOLOGICAL PRODUCT; GAS; ION; PEPTIDE; PROTEIN;

CHEMISTRY; CONFORMATION; GAS; MASS SPECTROMETRY; MOLECULAR DYNAMICS;

BIOLOGICAL PRODUCTS; GASES; IONS; MOLECULAR CONFORMATION; MOLECULAR DYNAMICS SIMULATION; PEPTIDES; PROTEINS; SPECTROMETRY, MASS, MATRIX-ASSISTED LASER DESORPTION-IONIZATION;

EID: 84919455803     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp509398e     Document Type: Article

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