The pre-trained GICnet models from "Four-dimensional-spacetime atomistic artificial intelligence models"
收藏Figshare2023-08-18 更新2026-04-08 收录
下载链接：
https://figshare.com/articles/dataset/The_pre-trained_GICnet_models_from_Four-dimensional-spacetime_atomistic_artificial_intelligence_models_/22723414/1
下载链接
链接失效反馈官方服务：
资源简介：
The pre-trained GICnet models from:Fuchun Ge, Lina Zhang, Arif Ullah, <b>Pavlo O. Dral*</b>. Four-dimensional spacetime atomistic artificial intelligence models. <i>J. Phys. Chem. Lett.</i> <b>2023</b>. DOI: 10.1021/acs.jpclett.3c01592. See also preprint on ChemRxiv.These models can be used to propagate molecular dynamics trajectories with the 4D-spacetime GICnet models. See https://github.com/dralgroup/mlatom/tree/gicnet for the instructions.
提供机构：
Ge, Fuchun; Dral, Pavlo O.; Hou, Yi-Fan; Ullah, Arif; Zhang, Lina; Chen, Yuxinxin
创建时间：
2023-08-18
