Molecualr dynamics study on the molecuar permeability of membrane protein
Molecualr dynamics study on the molecuar permeability of membrane protein
批准号:
23750008
负责人:
SAITO Hiroaki
金额:
$1.33万
依托单位:
依托单位国家:
日本
项目类别:
Grant-in-Aid for Young Scientists (B)
财政年份:
2011
资助国家:
日本
项目状态:
已结题
起止时间:
2011 至 2013
中文摘要
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英文摘要
We have carried out molecular dynamics simulations to analysis the structure and dynamics of peptide and membrane protein in several lipid bilayer environments and have investigated the ion and molecular permeability through the channel of membrane protein. The thermal stability of membrane protein in the lipid bilayers has also been investigated by free energy calculation.
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DOI:
10.1063/1.4794669
发表时间:
2013
期刊:
AIP Conference Proceedings
影响因子:
--
作者:
[H. Nagao, S. Kawamoto, M. Rusmerryani, A. Purqon, K. Kawaguchi, H. Saito]
通讯作者:
H. Saito
Structure and lateral pressure profile of lipid bilayer containing gramicidin A by molecular dynamicssimulation
分子动力学模拟含短杆菌肽A的脂质双层的结构和侧压分布
DOI:
--
发表时间:
2012
期刊:
影响因子:
--
作者:
[H. Saito, M. Iwayama, M. Nishimura, H. Takagi,K. Kawaguchi, H. Nagao]
通讯作者:
H. Nagao
Transition State Analysis of Azurin via Go-like Model
通过 Go-like 模型分析天青蛋白的过渡态
DOI:
10.1063/1.4794651
发表时间:
2013
期刊:
AIP Conf. Proc.
影响因子:
--
作者:
[Micke Rusmerryani, Meidy T. Pakpahan, Megumi Nishimura, Masako Takasu, Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao]
通讯作者:
Hidemi Nagao
GPGPUによるエネルギー分布関数計算の高速化
使用GPGPU加速能量分布函数计算
DOI:
--
发表时间:
2012
期刊:
影响因子:
--
作者:
[Koichiro Sadakane and Hideki Seto (oral presentation), 塩釜 拓仁,齋藤 大明,川口 一朋,長尾 秀実]
通讯作者:
塩釜 拓仁,齋藤 大明,川口 一朋,長尾 秀実
Analysis of water molecules in molecular dynamics simulations of H-ras GTP and GDP complexes
H-ras GTP 和 GDP 复合物分子动力学模拟中的水分子分析
DOI:
--
发表时间:
2012
期刊:
影响因子:
--
作者:
[T. Miyakawa, R. Morikawa, M. Takasu, K. Sugimori, K. Kawaguchi, H. Saito, Hidemi Nagao]
通讯作者:
Hidemi Nagao
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负责人:SAITO Hiroaki
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依托单位:
海外基金