An extended group additivity method for polycyclic thermochemistry estimation

K Han, A Jamal, CA Grambow… - … Journal of Chemical …, 2018 - Wiley Online Library
Automatic kinetic mechanism generation, virtual high‐throughput screening, and automatic
transition state search are currently trending applications requiring exploration of a large …
被引用次数：39 相关文章
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[PDF][PDF] An Extended Group Additivity Method for Polycyclic Thermochemistry Estimation

K Han - International Journal of Chemical Kinetics, 2018 - academia.edu
Automatic kinetic mechanism generation, virtual high-throughput screening, and automatic
transition state search are currently trending applications requiring exploration of a large …

An Extended Group Additivity Method for Polycyclic Thermochemistry Estimation

K Han, A Jamal, CA Grambow, Z Buras, WH Green Jr - 2018 - dspace.mit.edu
Automatic kinetic mechanism generation, virtual high‐throughput screening, and automatic
transition state search are currently trending applications requiring exploration of a large …

An Extended Group Additivity Method for Polycyclic Thermochemistry Estimation

K Han, A Jamal, CA Grambow, ZJ Buras… - International Journal of …, 2018 - osti.gov
Automatic kinetic mechanism generation, virtual high-throughput screening, and automatic
transition state search are currently trending applications requiring exploration of a large …