TY - RPRT TI - Learning Chemistry of Complex Reaction Systems via a Python First-Principles Reaction Rule Stencil (pReSt) Generator AU - Gupta, Udit AU - Vlachos, Dionisios G. PY - 2021 DO - 10.1021/acs.jcim.1c00297 UR - https://www.osti.gov/biblio/1858734 ID - 1858734 ER -