【摘 要】
：
We proposed a practical way for mapping the results of coarse-grained molecular simulations to the observables in hydrogen change experiments.By combining an atomic-interaction based coarse-grained model with an all-atom structure reconstruction algorithm
【基金项目】
：
the National Natural Science Foundation of China(Grant Nos.11974173 and 11934008),the HPC Center of Nanjing University。
论文部分内容阅读
We proposed a practical way for mapping the results of coarse-grained molecular simulations to the observables in hydrogen change experiments.By combining an atomic-interaction based coarse-grained model with an all-atom structure reconstruction algorithm
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