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Volumn 1, Issue 2, 1995, Pages 132-143

Hydrophobic Concave Surfaces and Cavities by Combination of Calix[4]arenes and Resorcin[4]arenes

Author keywords

calixarenes; cavitands; molecular modeling; resorcinarenes; supramolecular chemistry

Indexed keywords


EID: 84989571860     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.19950010207     Document Type: Article
Times cited : (56)

References (47)
  • 22
    • 84989555856 scopus 로고    scopus 로고
    • When the reaction between 26 and 9 was performed in a 2:1 ratio in DMF at 70°C. substantial amounts of 28 were still present after 20 h according to TLC.
  • 25
    • 84989567821 scopus 로고    scopus 로고
    • A holand is defined as a ligand which contains a permanent hole.
  • 27
    • 84989513896 scopus 로고    scopus 로고
    • 5]pyridine was added in order to break down the polymeric phthalocyanine structures.
  • 32
    • 84989513830 scopus 로고    scopus 로고
    • 2 groups of THF were also treated as an extended atom.
  • 36
    • 84989536371 scopus 로고    scopus 로고
    • It would be worthwhile to repeat the DOCK studies as described in [21] using DOCK 3.1 [30,31], in which electronic interactions between host and guest are taken into account in addition to van der Waals interactions. Moreover, it would be better to use the averaged structure over the last 100 ps Molecular Dynamics simulation rather than the energy‐minimized structure. since the averaged structure is a more realistic model of the structure of 33 in solution.
  • 44
    • 84989515182 scopus 로고    scopus 로고
    • Quanta purchased from Molecular Simulations, Burlington, MA, USA.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.