TY - RPRT TI - Parallel iterative reaction path optimization in ab initio quantum mechanical/molecular mechanical modeling of enzyme reactions. AU - Haiyan Liu AU - Zhenyu Lu AU - G Andres Cisneros AU - Weitao Yang PY - 2004 DO - 10.1063/1.1759318 UR - https://pubmed.ncbi.nlm.nih.gov/15260596/ ID - 15260596 ER -