DPA-1: Pretraining of Attention-based Deep Potential Model for Molecular Simulation.
Duo ZhangHangrui BiFu-Zhi DaiWanrun JiangLinfeng ZhangHan WangPublished in: CoRR (2022)
Keyphrases
- decision making
- mathematical model
- probabilistic model
- analytical model
- simulation model
- computational model
- genetic algorithm
- formal model
- conceptual model
- statistical model
- theoretical framework
- management system
- high level
- parameter estimation
- em algorithm
- numerical simulations
- decision trees
- agent model
- neural network
- simulation models
- discrete event
- agent based modeling