Molecular dynamics simulations of small glycine-(H2O)n (n = 2-7) clusters on semiempirical PM6 potential energy surfaces

Journal of Molecular Structure: THEOCHEM

Volumn 869, Issue 1-3, 2008, Pages 29-36

  Takayanagi, Toshiyuki ^a   Yoshikawa, Takehiro ^a   Kakizaki, Akira ^a   Shiga, Motoyuki ^b   Tachikawa, Masanori ^c  

^a SAITAMA UNIVERSITY   (Japan)

^b JAPAN ATOMIC ENERGY AGENCY   (Japan)

^c YOKOHAMA CITY UNIVERSITY   (Japan)

Author keywords

Cluster structure; Hydrate glycine; Molecular dynamics simulation; Semiempirical calculation

Indexed keywords

EID: 54049084487     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.08.016     Document Type: Article

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