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Volumn 101, Issue 5, 1997, Pages 782-791

Interactions of anesthetics with the water-hexane interface. A molecular dynamics study

Author keywords

[No Author keywords available]

Indexed keywords

ANESTHETICS; CALCULATIONS; COMPUTER SIMULATION; FREE ENERGY; INTERFACES (MATERIALS); MOLECULAR DYNAMICS; MOLECULES; ORGANIC COMPOUNDS; SOLUBILITY; SOLVENTS; WATER;

EID: 0031590888     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp961513o     Document Type: Article
Times cited : (75)

References (70)
  • 4
    • 0001941742 scopus 로고
    • Miller, R., Ed.; Churchill-Livingston: New York
    • Koblin, D. D. In Anesthesia; Miller, R., Ed.; Churchill-Livingston: New York, 1990; p 51.
    • (1990) Anesthesia , pp. 51
    • Koblin, D.D.1
  • 5
    • 0001460485 scopus 로고
    • Chapman, D., Ed.; Academic Press: New York
    • Janoff, A. S.; Miller, K. W. In Biological Membranes; Chapman, D., Ed.; Academic Press: New York, 1982; Vol. 4, p 417.
    • (1982) Biological Membranes , vol.4 , pp. 417
    • Janoff, A.S.1    Miller, K.W.2
  • 6
    • 5844368412 scopus 로고    scopus 로고
    • note
    • These compounds do not suppress movement in response to a noxious stimulus. However, at least some of them produce another effect characteristic to all anesthetics-amnesia. Thus, more precisely, they should he called nonimmobilizers.
  • 11
    • 5844412962 scopus 로고    scopus 로고
    • note
    • Both the (S,S)- and (S,R)-enantiomers were studied at the surface of water and hexane. Since the calculated and the measured solubilities as well as anesthetic potencies of these isomers are nearly identical, only the (S,R) enantiomer was studied in the water-hexane system.
  • 46
    • 5844321242 scopus 로고    scopus 로고
    • Unpublished results
    • Ionescu, P.; Eger, E. I. Unpublished results, 1996.
    • (1996)
    • Ionescu, P.1    Eger, E.I.2
  • 48
    • 5844425645 scopus 로고    scopus 로고
    • note
    • The free energy curves were positioned on the energy scale such that the end points would correspond to the calculated free energies of solvation in water and hexane. This was not exactly possible if the free energy of transfer from water to hexane calculated directly (column 6 in Table 3) and from individual free energies of solvation (column 8 in Table 3) were not the same. Then the difference was equally divided between both end points.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.