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Volumn 72, Issue 10, 2007, Pages 3640-3645

Cyclodextrin-driven movement of cucurbit[7]uril

Author keywords

[No Author keywords available]

Indexed keywords

BIPYRIDINIUM MOIETIES; CYCLODEXTRIN; EXOTHERMIC ENTHALPY CHANGES; PSEUDOROTAXANES;

EID: 34248571268     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo0624288     Document Type: Article
Times cited : (100)

References (54)
  • 49
    • 34248513675 scopus 로고    scopus 로고
    • See the the Supporting Information
    • See the the Supporting Information.
  • 52
    • 9144240095 scopus 로고    scopus 로고
    • A 100 ps MD simulation is performed by using the NVT ensemble with a time step of 1 fs at 298 K using the Dreiding force field (Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III. J. Phys. Chem. 1990, 94, 8897). The cutoff distance is 9 Å with a buffer length of 0.5 Å.
    • A 100 ps MD simulation is performed by using the NVT ensemble with a time step of 1 fs at 298 K using the Dreiding force field (Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III. J. Phys. Chem. 1990, 94, 8897). The cutoff distance is 9 Å with a buffer length of 0.5 Å.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.