论文标题
增强事件序列的过渡路径理论
Augmented Transition Path Theory for Sequences of Events
论文作者
论文摘要
过渡路径理论提供了反应动力学的统计描述，从局部空间数量来看。在其原始公式中，它仅限于由从反应物集a的轨迹组成的反应。我们将过渡路径理论的基本概念和原理扩展到反应，其中轨迹表现出一系列事件的序列，并说明了该概述在示例上的效用。
Transition path theory provides a statistical description of the dynamics of a reaction in terms of local spatial quantities. In its original formulation, it is limited to reactions that consist of trajectories flowing from a reactant set A to a product set B. We extend the basic concepts and principles of transition path theory to reactions in which trajectories exhibit a specified sequence of events and illustrate the utility of this generalization on examples.
