메뉴 건너뛰기




Volumn 107, Issue 42, 2003, Pages 11774-11783

ATP hydrolysis in water - A density functional study

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ENERGY; ASSOCIATION REACTIONS; CHEMICAL BONDS; COMPUTER SIMULATION; DISSOCIATION; HYDROLYSIS; MAGNESIUM PRINTING PLATES; PHOSPHATES; PROBABILITY DENSITY FUNCTION; WATER;

EID: 0242573649     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp035538g     Document Type: Article
Times cited : (94)

References (72)
  • 35
    • 0003925486 scopus 로고
    • Max-Planck-Institut für Festkörperforschung, Stuttgart, Germany, and IBM Research
    • CPMD program version 3.4, Hutter, J. et al., Max-Planck-Institut für Festkörperforschung, Stuttgart, Germany, and IBM Research 1990-2001.
    • (1990) CPMD Program Version 3.4
    • Hutter, J.1
  • 62
    • 0242686520 scopus 로고    scopus 로고
    • note
    • The criteria for a hydrogen bond are 2.2 Å for the O···H distance and 120° for the O-H···O angle.
  • 63
    • 0242517840 scopus 로고    scopus 로고
    • note
    • A vanishing force of constraint does not necessarily mean a completed reaction in a periodic system.
  • 64
    • 85087536202 scopus 로고    scopus 로고
    • note
    • p and ΔF at the potential energy minimum.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.