| Comment on the correct use of continuum solvent models J Ho, A Klamt, ML Coote The journal of physical chemistry A 114 (51), 13442-13444, 2010 | 543 | 2010 |
| A universal approach for continuum solvent pK a calculations: are we there yet? J Ho, ML Coote Theoretical Chemistry Accounts 125, 3-21, 2010 | 529 | 2010 |
| Computational electrochemistry: prediction of liquid-phase reduction potentials AV Marenich, J Ho, ML Coote, CJ Cramer, DG Truhlar Physical Chemistry Chemical Physics 16 (29), 15068-15106, 2014 | 499 | 2014 |
| Eigenvector centrality for characterization of protein allosteric pathways CFA Negre, UN Morzan, HP Hendrickson, R Pal, GP Lisi, JP Loria, ... Proceedings of the National Academy of Sciences 115 (52), E12201-E12208, 2018 | 226 | 2018 |
| Are thermodynamic cycles necessary for continuum solvent calculation of p K as and reduction potentials? J Ho Physical Chemistry Chemical Physics 17 (4), 2859-2868, 2015 | 212 | 2015 |
| Calculating free energy changes in continuum solvation models J Ho, MZ Ertem The Journal of Physical Chemistry B 120 (7), 1319-1329, 2016 | 175 | 2016 |
| pKa Calculation of Some Biologically Important Carbon Acids - An Assessment of Contemporary Theoretical Procedures J Ho, ML Coote Journal of Chemical Theory and Computation 5 (2), 295-306, 2009 | 156 | 2009 |
| First‐principles prediction of acidities in the gas and solution phase J Ho, ML Coote Wiley Interdisciplinary Reviews: Computational Molecular Science 1 (5), 649-660, 2011 | 137 | 2011 |
| Predicting pKa in implicit solvents: current status and future directions J Ho Australian Journal of Chemistry 67 (10), 1441-1460, 2014 | 112 | 2014 |
| Structure–function relationships of donor–acceptor Stenhouse adduct photochromic switches N Mallo, ED Foley, H Iranmanesh, ADW Kennedy, ET Luis, J Ho, ... Chemical Science 9 (43), 8242-8252, 2018 | 111 | 2018 |
| Photoinduced proton‐transfer reactions for mild O‐H functionalization of unreactive alcohols S Jana, Z Yang, F Li, C Empel, J Ho, RM Koenigs Angewandte Chemie International Edition 59 (14), 5562-5566, 2020 | 110 | 2020 |
| Tryptamine synthesis by iron porphyrin catalyzed C− H functionalization of indoles with diazoacetonitrile KJ Hock, A Knorrscheidt, R Hommelsheim, J Ho, MJ Weissenborn, ... Angewandte Chemie International Edition 58 (11), 3630-3634, 2019 | 106 | 2019 |
| Tropylium-promoted carbonyl–olefin metathesis reactions UPN Tran, G Oss, DP Pace, J Ho, TV Nguyen Chemical science 9 (23), 5145-5151, 2018 | 93 | 2018 |
| Machine-learning-assisted free energy simulation of solution-phase and enzyme reactions X Pan, J Yang, R Van, E Epifanovsky, J Ho, J Huang, J Pu, Y Mei, K Nam, ... Journal of chemical theory and computation 17 (9), 5745-5758, 2021 | 86 | 2021 |
| pH-regulated nonelectrogenic anion transport by Phenylthiosemicarbazones ENW Howe, N Busschaert, X Wu, SN Berry, J Ho, ME Light, DD Czech, ... Journal of the American Chemical Society 138 (26), 8301-8308, 2016 | 85 | 2016 |
| Theoretical calculation of reduction potentials J Ho, ML Coote, CJ Cramer, DG Truhlar Organic electrochemistry 5, 229-259, 2015 | 79 | 2015 |
| Accuracy of DLPNO-CCSD (T): Effect of basis set and system size I Sandler, J Chen, M Taylor, S Sharma, J Ho The Journal of Physical Chemistry A 125 (7), 1553-1563, 2021 | 77 | 2021 |
| Just add sugar for carbohydrate induced self-assembly of curcumin S Wong, J Zhao, C Cao, CK Wong, RP Kuchel, S De Luca, JM Hook, ... Nature Communications 10 (1), 582, 2019 | 68 | 2019 |
| Accurate Line Shapes from Sub‑1 cm−1 Resolution Sum Frequency Generation Vibrational Spectroscopy of α‑Pinene at Room Temperature AL Mifflin, L Velarde, J Ho, BT Psciuk, CFA Negre, CJ Ebben, MA Upshur, ... Journal of Physical Chemistry A 119, 1291-1302, 2015 | 60 | 2015 |
| Harnessing entropy to direct the bonding/debonding of polymer systems based on reversible chemistry NK Guimard, J Ho, J Brandt, CY Lin, M Namazian, JO Mueller, ... Chemical Science 4 (7), 2752-2759, 2013 | 60 | 2013 |
Michelle CooteMatthew Flinders Professor in Chemistry, Flinders UniversityVerified email at flinders.edu.au
