MD Simulation Trajectories of the Best Ligand: Flavonoid Screening for RIPK1 Inhibitors
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资源简介：
Screening flavonoids using molecular docking, pharmacokinetic profiling, molecular dynamics simulations, and free energy calculations. Trajectories were prepared with gmx trjconv with the option -dt 100 to reduce the file size.
创建时间：
2023-10-29
