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5. Protonation-Modulated Localization of Excess Electron in Histidine Aqueous Solutions

Protonation-Modulated Localization of Excess Electron in Histidine Aqueous Solutions

来源 :第十三届全国量子化学会议 | 被引量 : 0次 | 上传用户：dyyangcheng

【摘 要】

：

　　In this work,we present an ab initio molecular dynamics simulation study on the interaction of an excess electron(EE)with histidine in its neutral or slight

【作 者】

：

Liang Gao Yuxiang Bu 

【机 构】

：

School of Chemistry and Chemical Engineering,Shandong University,Jinan,250100

【出 处】

：

第十三届全国量子化学会议

【发表日期】

：

2017年期

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　　In this work,we present an ab initio molecular dynamics simulation study on the interaction of an excess electron(EE)with histidine in its neutral or slightly acidic aqueous solution.

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