Electrostatic catalysis of a Diels–Alder reaction AC Aragones, NL Haworth, N Darwish, S Ciampi, EJ Mannix, GG Wallace, ... Nature 531 (7592), 88-91, 2016 | 796 | 2016 |
Disulfides as redox switches: from molecular mechanisms to functional significance MA Wouters, SW Fan, NL Haworth Antioxidants & redox signaling 12 (1), 53-91, 2010 | 275 | 2010 |
Heats of formation of hydrofluorocarbons obtained by Gaussian-3 and related quantum chemical computations NL Haworth, MH Smith, GB Bacskay, JC Mackie The Journal of Physical Chemistry A 104 (32), 7600-7611, 2000 | 73 | 2000 |
Mechanical stretching-induced electron-transfer reactions and conductance switching in single molecules Y Li, NL Haworth, L Xiang, S Ciampi, ML Coote, N Tao Journal of the American Chemical Society 139 (41), 14699-14706, 2017 | 72 | 2017 |
“Forbidden” disulfides: their role as redox switches MA Wouters, RA George, NL Haworth Current protein and peptide science 8 (5), 484-495, 2007 | 68 | 2007 |
Modeling Flexible Molecules in Solution: A pKa Case Study NL Haworth, Q Wang, ML Coote The Journal of Physical Chemistry A 121 (27), 5217-5225, 2017 | 64 | 2017 |
Tuning electron transfer through p-phenyleneethynylene molecular wires C Atienza, N Martín, M Wielopolski, N Haworth, T Clark, DM Guldi Chemical communications, 3202-3204, 2006 | 58 | 2006 |
An ab initio quantum chemical and kinetic study of the NNH+ O reaction potential energy surface: How important is this route to NO in combustion? NL Haworth, JC Mackie, GB Bacskay The Journal of Physical Chemistry A 107 (35), 6792-6803, 2003 | 50 | 2003 |
Conformational changes in redox pairs of protein structures SW Fan, RA George, NL Haworth, LL Feng, JY Liu, MA Wouters Protein Science 18 (8), 1745-1765, 2009 | 48 | 2009 |
Evaluating the stability of disulfide bridges in proteins: a torsional potential energy surface for diethyl disulfide NL Haworth, JE Gready, RA George, MA Wouters Molecular simulation 33 (6), 475-485, 2007 | 48 | 2007 |
Heats of formation of phosphorus compounds determined by current methods of computational quantum chemistry NL Haworth, GB Bacskay The Journal of chemical physics 117 (24), 11175-11187, 2002 | 47 | 2002 |
Design of redox/radical sensing molecules via nitrile imine-mediated tetrazole-ene cycloaddition (NITEC) P Lederhose, NL Haworth, K Thomas, SE Bottle, ML Coote, ... The Journal of Organic Chemistry 80 (16), 8009-8017, 2015 | 45 | 2015 |
eld, GG Wallace, I. Diez-Perez and ML Coote AC Aragones, NL Haworth, N Darwish, S Ciampi, NJ Bloom Nature 531, 88-91, 2016 | 39 | 2016 |
Thiol-based redox signalling: rust never sleeps MA Wouters, S Iismaa, SW Fan, NL Haworth The international journal of biochemistry & cell biology 43 (8), 1079-1085, 2011 | 36 | 2011 |
Insulin in motion: The A6-A11 disulfide bond allosterically modulates structural transitions required for insulin activity B Van Lierop, SC Ong, A Belgi, C Delaine, S Andrikopoulos, NL Haworth, ... Scientific reports 7 (1), 17239, 2017 | 33 | 2017 |
The role of phosphorus dioxide in the H+ OH recombination reaction: Ab initio quantum chemical computation of thermochemical and rate parameters NL Haworth, GB Bacskay, JC Mackie The Journal of Physical Chemistry A 106 (8), 1533-1541, 2002 | 32 | 2002 |
Ambient temperature transition-metal-free dissociative electron transfer reversible addition–fragmentation chain transfer polymerization (DET-RAFT) of methacrylates, acrylates … P Maximiano, PV Mendonca, JRC Costa, NL Haworth, AC Serra, ... Macromolecules 49 (5), 1597-1604, 2016 | 31 | 2016 |
Diagnosis of the Redox Levels of TCNQF4 Compounds Using Vibrational Spectroscopy NL Haworth, J Lu, N Vo, TH Le, CD Thompson, AM Bond, LL Martin ChemPlusChem 79 (7), 962-972, 2014 | 28 | 2014 |
Reactions of phosphorus-containing species of importance in the catalytic recombination of H+ OH: Quantum chemical and kinetic studies JC Mackie, GB Bacskay, NL Haworth The Journal of Physical Chemistry A 106 (45), 10825-10830, 2002 | 27 | 2002 |
Investigation of the Redox and Acid‐Base properties of TCNQF and TCNQF2: Electrochemistry, Vibrational Spectroscopy, and Substituent Effects N Vo, NL Haworth, AM Bond, LL Martin ChemElectroChem 5 (8), 1173-1185, 2018 | 26 | 2018 |