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Volumn 107, Issue 23, 2003, Pages 5630-5641

Simulation and modeling of the Rhodobacter sphaeroides bacterial reaction center II: Primary charge separation

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRIC CHARGE; FREE ENERGY; POLARIZATION; WATER;

EID: 0038339489     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0303422     Document Type: Article
Times cited : (34)

References (71)
  • 48
    • 0003925486 scopus 로고
    • CPMD, program version 3.0
    • Max Planck Insitut für Festkörperforschung and IBM Research
    • Hutter, J. CPMD, program version 3.0; Technical report; Max Planck Insitut für Festkörperforschung and IBM Research: 1990-1999.
    • (1990) Technical Report
    • Hutter, J.1
  • 71
    • 0037918487 scopus 로고    scopus 로고
    • note
    • The calculation of the averaged dipole moment was carried out by performing 100-ps MD simulations of water and methanol in the NVE ensemble for systems containing 250 molecules. For methanol, we used the electrostatic force field described in ref 69.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.