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[会议论文] 作者:Liang Peng,Daoling Peng,Feng Long Gu,Weitao Yang, 来源:第十三届全国量子化学会议 年份:2017
  A linear scaling method based on non-orthogonal localized molecular orbitals(NOLMO)has been proposed.NOLMOs are the most localized representation of electro...
[会议论文] 作者:Daoling Peng,Liang Peng,Feng Long Gu,Weitao Yang, 来源:第十三届全国量子化学会议 年份:2017
Time dependent density functional theory(TDDFT)is a useful tool to calculate molecular properties with reasonable computational costs comparing to wave function based ab initio approaches.A linear sca...
[会议论文] 作者:Abing Duan,Peiyuan Yu,Fang Liu,Feng Long Gu,K.N.Houk, 来源:第十三届全国量子化学会议 年份:2017
The first experimental examples of Diels–Alder(DA)reactions of diazo compounds as heterodienophiles with dienes have been studied with density functional theory(DFT)using the M06-2X functional....
[期刊论文] 作者:Yu Liu,Fujin Yang,Linglin Feng,Long Yang,Lingyun Chen,Gang Wei,Weiyue Lu, 来源:药学学报(英文版) 年份:2017
The purpose of this study is to evaluate the in vivo retention capabilities of poloxamer-based in situ hydrogels for vaginal application with nonoxinol-9 as the...
[期刊论文] 作者:Yu Liu,Fujin Yang,Linglin Feng,Long Yang,Lingyun Chen,Gang Wei,Weiyue Lu,, 来源:Acta Pharmaceutica Sinica B 年份:2017
The purpose of this study is to evaluate the in vivo retention capabilities of poloxamer-based in situ hydrogels for vaginal application with nonoxinol-9 as the...
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