Simulation POPC_9_POPC_512_NaCl_150mM_310K_rep2

<strong>Title publication: </strong><em>A Ceramide-Regulated Element in the Late Endosomal Protein LAPTM4B Controls Amino Acid Transporter Interaction</em> <strong><strong>Year publication:</strong></strong><strong> </strong>2018 <strong>DOI publication: </strong>10.1021/acscentsci.7b00582 <strong>Description:</strong> Simulation POPC membrane containing 9 POPC originally in the water phase using charmm36 at 310K. <strong>MD engine:</strong> gromacs 2018 <strong>Force field</strong>: charmm36 <strong>Temperature</strong>: 310 K <strong>Pressure:</strong> 1 bar <strong>Simulation time</strong>: 3800 ns <strong>Saving frequency</strong>: 100 ps <strong>Molecular content</strong>:<br> POPC 521<br> SOL 34248<br> NA 92<br> CL 92 <strong>Additional </strong><strong>information</strong>:<strong>论文标题：</strong><em>晚期内体蛋白LAPTM4B中受神经酰胺（Ceramide）调控的元件调控氨基酸转运体（amino acid transporter）相互作用</em><br><strong>出版年份：</strong>2018<br><strong>出版DOI：</strong>10.1021/acscentsci.7b00582<br><strong>数据集描述：</strong>采用CHARMM36力场，于310K温度下对包含9个初始处于水相的POPC的POPC膜体系开展分子动力学模拟。<br><strong>分子动力学模拟引擎：</strong>GROMACS 2018<br><strong>力场：</strong>CHARMM36<br><strong>温度：</strong>310 K<br><strong>压强：</strong>1巴<br><strong>模拟时长：</strong>3800纳秒<br><strong>数据保存频率：</strong>100皮秒<br><strong>分子组成：</strong><br>POPC：521<br>SOL：34248<br>NA：92<br>CL：92<br><strong>附加信息：</strong>