J
Ji-Cai Fan
Researcher at Zhejiang University
Publications - 13
Citations - 304
Ji-Cai Fan is an academic researcher from Zhejiang University. The author has contributed to research in topics: Solvent effects & Density functional theory. The author has an hindex of 9, co-authored 13 publications receiving 289 citations.
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Ab initio calculations on halogen-bonded complexes and comparison with density functional methods
TL;DR: The calculations described herein have shown that the CCSD(T) CBS limits yield binding energies with a range of −0.89 to −4.38 kcal/mol for the halogen‐bonded complexes under study.
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Synthetic and theoretical study on proline-catalyzed Knoevenagel condensation in ionic liquid
TL;DR: In this paper, the Knoevenagel condensation of diethylmalonate and various aldehydes catalyzed by proline in a common ionic liquid was achieved.
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Binding interactions of pefloxacin mesylate with bovine lactoferrin and human serum albumin.
TL;DR: The binding of pefloxacin mesylate to bovine lactoferrin and human serum albumin in dilute aqueous solution was studied using fluorescence spectra and absorbance spectra using Förster-type dipole-dipole nonradiative energy-transfer.
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Polyethylene Glycol as a Nonionic Liquid Solvent for the Synthesis of N-Alkyl and N-Arylimides
TL;DR: Polyethylene glycol (PEG) is an inexpensive, nontoxic, environmentally friendly reaction medium for the synthesis of N-alkyl and N-arylphthalimides to afford the corresponding adducts in excellent yields under mild reaction conditions.
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Systematic theoretical investigations on the tautomers of thymine in gas phase and solution
TL;DR: In this paper, the tautomers of thymine are systematically calculated using various methods and the order of relative stability, dipole moment as well as solvent effect of the 13 isomers are investigated.