Molecular dynamics trajectories of protein folding are deposited for educational purposes. Currently, the following trajectories are available: Chignolin (five independent NVT simulations up to 1.5 mi

Zenodo2022-03-13 更新40

Proteins and protein/DNA/RNA complexes involved in biosynthesis, protein fold...

RNA生物合成机制

蛋白质折叠

Pathogenesis and immune responses are very complex, multi-component processes. Understanding the molecular mechanisms underlying these processes is essential for their...

B2FIND20

Crystal structure of EV71 3C proteinase

病毒蛋白酶结构域

结构生物学

Crystal structure of EV71 3C proteinase

NIAID Data Ecosystem40

Sampling enhancement by metadynamics driven by machine learning and de novo p...

蛋白质折叠

机器学习分子动力学

Folding of villin miniprotein was studied by parallel tempering metadynamics driven by machine learning. To obtain a training set for machine learning, we generated a large...

B2FIND20