Determination of the potential of mean force of aromatic amino acid complexes in various solvents using molecular dynamics simulations: The case of the tryptophan-histidine pair

Journal of Physical Chemistry B

Volumn 105, Issue 32, 2001, Pages 7835-7846

  Luigi Gervasio, Francesco ^a,b   Chelli, Riccardo ^a,b   Marchi, Massimo ^a,b,c   Procacci, Piero ^a,b   Schettino, Vincenzo ^a,b  

^a UNIVERSITY OF FLORENCE   (Italy)

^b UNIVERSITY OF FLORENCE   (Italy)

^c DIF   (France)

Author keywords

[No Author keywords available]

Indexed keywords

MICROSOLVATION;

AROMATIC COMPOUNDS; CARBON TETRACHLORIDE; COMPUTER SIMULATION; CRYSTALLOGRAPHY; FREE ENERGY; HYDROGEN BONDS; HYDROPHOBICITY; METHANOL; MOLECULAR DYNAMICS; WATER;

AMINO ACIDS;

EID: 0035899738     PISSN: 10895647     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp010434w     Document Type: Article

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