Formation of benzene in the interstellar medium BM Jones, F Zhang, RI Kaiser, A Jamal, AM Mebel, MA Cordiner, ... Proceedings of the National Academy of Sciences 108 (2), 452-457, 2011 | 164 | 2011 |
Unimolecular reaction pathways of a γ-ketohydroperoxide from combined application of automated reaction discovery methods CA Grambow, A Jamal, YP Li, WH Green, J Zádor, YV Suleimanov Journal of the American Chemical Society 140 (3), 1035-1048, 2018 | 109 | 2018 |
A comparative study of modern homology modeling algorithms for rhodopsin structure prediction DM Nikolaev, AA Shtyrov, MS Panov, A Jamal, OB Chakchir, ... ACS omega 3 (7), 7555-7566, 2018 | 61 | 2018 |
An extended group additivity method for polycyclic thermochemistry estimation K Han, A Jamal, CA Grambow, ZJ Buras, WH Green International Journal of Chemical Kinetics 50 (4), 294-303, 2018 | 38 | 2018 |
An Experimental and Theoretical Study on the Formation of 2-Methylnaphthalene (C11H10/C11H3D7) in the Reactions of the Para-Tolyl (C7H7) and Para-Tolyl-d7 (C7D7) with … DSN Parker, BB Dangi, RI Kaiser, A Jamal, MN Ryazantsev, K Morokuma, ... The Journal of Physical Chemistry A 118 (15), 2709-2718, 2014 | 31 | 2014 |
An ab initio/RRKM study of the reaction mechanism and product branching ratios of the reactions of ethynyl radical with allene and methylacetylene A Jamal, AM Mebel Physical Chemistry Chemical Physics 12 (11), 2606-2618, 2010 | 31 | 2010 |
Experimental and ab initio investigation of the products of reaction from Δ9-tetrahydrocannabinol (Δ9-THC) and the fast blue BB spot reagent in presumptive drug tests for … HS Franca, A Acosta, A Jamal, W Romao, J Mulloor, JR Almirall Forensic Chemistry 17, 100212, 2020 | 26 | 2020 |
Global investigation of potential energy surfaces for the pyrolysis of C 1–C 3 hydrocarbons: Toward the development of detailed kinetic models from first principles MN Ryazantsev, A Jamal, S Maeda, K Morokuma Physical Chemistry Chemical Physics 17 (41), 27789-27805, 2015 | 26 | 2015 |
Separation mechanism of chiral impurities, ephedrine and pseudoephedrine, found in amphetamine-type substances using achiral modifiers in the gas phase HK Holness, A Jamal, A Mebel, JR Almirall Analytical and bioanalytical chemistry 404, 2407-2416, 2012 | 26 | 2012 |
A combined crossed molecular beam and theoretical investigation of the reaction of the meta-tolyl radical with vinylacetylene–toward the formation of methylnaphthalenes T Yang, L Muzangwa, RI Kaiser, A Jamal, K Morokuma Physical Chemistry Chemical Physics 17 (33), 21564-21575, 2015 | 23 | 2015 |
A combined experimental and theoretical study on the gas-phase synthesis of toluene under single collision conditions. BB Dangi, DSN Parker, RI Kaiser, A Jamal, AM Mebel Angewandte Chemie International Edition 52 (28), 2013 | 22 | 2013 |
A crossed beams and ab initio investigation on the formation of cyanodiacetylene in the reaction of cyano radicals with diacetylene F Zhang, S Kim, RI Kaiser, A Jamal, AM Mebel The Journal of chemical physics 130 (23), 2009 | 22 | 2009 |
Phenyl radical+ propene: a prototypical reaction surface for aromatic-catalyzed 1, 2-hydrogen-migration and subsequent resonance-stabilized radical formation ZJ Buras, TC Chu, A Jamal, NW Yee, JE Middaugh, WH Green Physical Chemistry Chemical Physics 20 (19), 13191-13214, 2018 | 20 | 2018 |
Theoretical investigation of the mechanism and product branching ratios of the reactions of cyano radical with 1-and 2-butyne and 1, 2-butadiene A Jamal, AM Mebel The Journal of Physical Chemistry A 117 (4), 741-755, 2013 | 19 | 2013 |
Formation of 6-Methyl-1,4-dihydronaphthalene in the Reaction of the p-Tolyl Radical with 1,3-Butadiene under Single-Collision Conditions DSN Parker, BB Dangi, RI Kaiser, A Jamal, M Ryazantsev, K Morokuma The Journal of Physical Chemistry A 118 (51), 12111-12119, 2014 | 18 | 2014 |
Reactions of C2H with 1- and 2-Butynes: An Ab Initio/RRKM Study of the Reaction Mechanism and Product Branching Ratios A Jamal, AM Mebel The Journal of Physical Chemistry A 115 (11), 2196-2207, 2011 | 14 | 2011 |
A crossed molecular beam and ab initio study on the formation of 5-and 6-methyl-1, 4-dihydronaphthalene (C 11 H 12) via the reaction of meta-tolyl (C 7 H 7) with 1, 3-butadiene … LG Muzangwa, T Yang, DSN Parker, RI Kaiser, AM Mebel, A Jamal, ... Physical Chemistry Chemical Physics 17 (12), 7699-7706, 2015 | 9 | 2015 |
An ab initio/RRKM study of the reaction mechanism and product branching ratios of the reactions of ethynyl radical with 1, 2-butadiene A Jamal, AM Mebel Chemical Physics Letters 518, 29-37, 2011 | 6 | 2011 |
Allowed energetic pathways for the three-body recombination reaction of nitrogen monoxide with the hydroxyl radical and their potential atmospheric implications L D’Ottone, A Jamal Orbital: The Electronic Journal of Chemistry, 2010 | 2 | 2010 |
Automated Reaction Discovery from Combined Application of Transition State Search Algorithms C Grambow, A Jamal, YP Li, J Zádor, Y Suleimanov, W Green APS March Meeting Abstracts 2018, B34. 007, 2018 | 1 | 2018 |