Genesys: Kinetic model construction using chemo-informatics NM Vandewiele, KM Van Geem, MF Reyniers, GB Marin Chemical Engineering Journal 207, 526-538, 2012 | 173 | 2012 |
Automatic mechanism and kinetic model generation for gas‐and solution‐phase processes: a perspective on best practices, recent advances, and future challenges R Van de Vijver, NM Vandewiele, PL Bhoorasingh, BL Slakman, ... International Journal of Chemical Kinetics 47 (4), 199-231, 2015 | 136 | 2015 |
JP-10 combustion studied with shock tube experiments and modeled with automatic reaction mechanism generation CW Gao, AG Vandeputte, NW Yee, WH Green, RE Bonomi, GR Magoon, ... Combustion and Flame 162 (8), 3115-3129, 2015 | 102 | 2015 |
Experimental and modeling study on the thermal decomposition of jet propellant-10 NM Vandewiele, GR Magoon, KM Van Geem, MF Reyniers, WH Green, ... Energy & Fuels 28 (8), 4976-4985, 2014 | 61 | 2014 |
Kinetic modeling of jet propellant-10 pyrolysis NM Vandewiele, GR Magoon, KM Van Geem, MF Reyniers, WH Green, ... Energy & Fuels 29 (1), 413-427, 2015 | 55 | 2015 |
A comparison of deep learning performances with other machine learning algorithms on credit scoring unbalanced data L Marceau, L Qiu, N Vandewiele, E Charton arXiv preprint arXiv:1907.12363, 2019 | 31 | 2019 |
Automated reaction kinetics and network exploration (Arkane): A statistical mechanics, thermodynamics, transition state theory, and master equation software AG Dana, MS Johnson, JW Allen, S Sharma, S Raman, M Liu, CW Gao, ... International Journal of Chemical Kinetics 55 (6), 300-323, 2023 | 30 | 2023 |
Rule-based ab initio kinetic model for alkyl sulfide pyrolysis R Van de Vijver, NM Vandewiele, AG Vandeputte, KM Van Geem, ... Chemical Engineering Journal 278, 385-393, 2015 | 25 | 2015 |
Symmetry calculation for molecules and transition states NM Vandewiele, R Van de Vijver, KM Van Geem, MF Reyniers, GB Marin Journal of Computational Chemistry 36 (3), 181-192, 2015 | 13 | 2015 |
Computer-generated isotope model achieves experimental accuracy of filiation for position-specific isotope analysis MJ Goldman, NM Vandewiele, S Ono, WH Green Chemical Geology 514, 1-9, 2019 | 12 | 2019 |
Implementation of stereochemistry in automatic kinetic model generation NM Vandewiele, R Van de Vijver, HH Carstensen, KM Van Geem, ... International Journal of Chemical Kinetics 48 (12), 755-769, 2016 | 11 | 2016 |
Kinetic study of the thermal rearrangement of cis-and trans-2-pinanol NM Vandewiele, KM Van Geem, MF Reyniers, GB Marin Journal of Analytical and Applied Pyrolysis 90 (2), 187-196, 2011 | 11 | 2011 |
Scalability strategies for automated reaction mechanism generation A Jocher, NM Vandewiele, K Han, M Liu, CW Gao, RJ Gillis, WH Green Computers & Chemical Engineering 131, 106578, 2019 | 9 | 2019 |
Kinetic model construction using chemoinformatics N Vandewiele Ghent University, 2014 | 2 | 2014 |
Automatic reaction network using chemo-informatics N Vandewiele, K Van Geem, MF Reyniers, G Marin 2011 AIChE Annual meeting, 2011 | 2 | 2011 |
Automatic mechanism and kinetic model generation: a perspective on best practices, recent advances, and future challenges R Van de Vijver, N Vandewiele, PL Bhoorasingh, BL Slakman, ... International Journal of Chemical Kinetics 47 (4), 199-231, 2015 | 1 | 2015 |
CFD Analysis of a Rotating Fluidized Bed Reactor in a Static Geometry System N Vandewiele Master’s thesis, Universiteit Gent, Laboratorium voor Petrochemische …, 2008 | 1 | 2008 |
Scalable algorithms in automatic mechanism generation for complex fuel systems N Vandewiele, K Han, W Green ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |
Recent advances (and continuing challenges) in combustion chemistry WH Green, SS Merchant, A Vandeputte, CW Gao, N Vandewiele, NW Yee, ... International Conference on Chemical Kinetics (ICCK 2015), 24-27, 2015 | | 2015 |
Quantitative oxidation studies of a synthetic jet fuel, JP-10 RA Edwards, DK Lewis, HW Wong, GR Magoon, NW Yee, ... ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 245, 2013 | | 2013 |