Regulate PD-L1's Membrane Orientation Thermodynamics with Hydrophobic Nanoparticles

The trajectories.zip includes the main trajectories, detailed parameter (e.g., /traj/1NP_3/1NP_3_copy1/toppar/NP.itp), initial conformation files (e.g., /traj/1NP_3/1NP_3_copy1/mix-pre.gro), the conformation file of the last frame (e.g., /traj/1NP_3/1NP_3_copy1/mix-md.gro) and the "in-house" script used for analysis.轨迹压缩包（trajectories.zip）包含主轨迹文件、详细参数文件（示例路径：/traj/1NP_3/1NP_3_copy1/toppar/NP.itp）、初始构象文件（示例路径：/traj/1NP_3/1NP_3_copy1/mix-pre.gro）、末帧构象文件（示例路径：/traj/1NP_3/1NP_3_copy1/mix-md.gro），以及用于数据分析的自研脚本。