| Docking: successes and challenges V Mohan, AC Gibbs, MD Cummings, EP Jaeger, RL DesJarlais Current pharmaceutical design 11 (3), 323-333, 2005 | 301 | 2005 |
| Comparison of automated docking programs as virtual screening tools MD Cummings, RL DesJarlais, AC Gibbs, V Mohan, EP Jaeger Journal of medicinal chemistry 48 (4), 962-976, 2005 | 288 | 2005 |
| Solution Structure of Carnobacteriocin B2 and Implications for Structure−Activity Relationships among Type IIa Bacteriocins from Lactic Acid Bacteria, Y Wang, ME Henz, NL Fregeau Gallagher, S Chai, AC Gibbs, LZ Yan, ... Biochemistry 38 (47), 15438-15447, 1999 | 146 | 1999 |
| Unusual β-sheet periodicity in small cyclic peptides AC Gibbs, LH Kondejewski, W Gronwald, AM Nip, RS Hodges, BD Sykes, ... Nature structural biology 5 (4), 284-288, 1998 | 146 | 1998 |
| Probing the structural determinants of type II ‘β-turn formation in peptides and Proteins AC Gibbs, TC Bjorndahl, RS Hodges, DS Wishart Journal of the American Chemical Society 124 (7), 1203-1213, 2002 | 136 | 2002 |
| Conformational sampling of bioactive molecules: a comparative study DK Agrafiotis, AC Gibbs, F Zhu, S Izrailev, E Martin Journal of chemical information and modeling 47 (3), 1067-1086, 2007 | 132 | 2007 |
| Insensitivity to pain induced by a potent selective closed-state Nav1. 7 inhibitor M Flinspach, Q Xu, AD Piekarz, R Fellows, R Hagan, A Gibbs, Y Liu, ... Scientific reports 7 (1), 39662, 2017 | 125 | 2017 |
| Analysis of the structural and molecular basis of voltage-sensitive sodium channel inhibition by the spider toxin huwentoxin-IV (μ-TRTX-Hh2a) NA Minassian, A Gibbs, AY Shih, Y Liu, RA Neff, SW Sutton, ... Journal of Biological Chemistry 288 (31), 22707-22720, 2013 | 86 | 2013 |
| Fusion to a highly stable consensus albumin binding domain allows for tunable pharmacokinetics SA Jacobs, AC Gibbs, M Conk, F Yi, D Maguire, C Kane, KT O'Neil Protein Engineering, Design and Selection 28 (10), 385-393, 2015 | 78 | 2015 |
| Analogues of bacteriocins: antimicrobial specificity and interactions of leucocin A with its enantiomer, carnobacteriocin B2, and truncated derivatives LZ Yan, AC Gibbs, ME Stiles, DS Wishart, JC Vederas Journal of medicinal chemistry 43 (24), 4579-4581, 2000 | 76 | 2000 |
| Nanosecond temperature jump relaxation dynamics of cyclic β-hairpin peptides SJ Maness, S Franzen, AC Gibbs, TP Causgrove, RB Dyer Biophysical journal 84 (6), 3874-3882, 2003 | 65 | 2003 |
| Synthesis and identification of [1, 2, 4] thiadiazole derivatives as a new series of potent and orally active dual agonists of peroxisome proliferator-activated receptors α and δ L Shen, Y Zhang, A Wang, E Sieber-McMaster, X Chen, P Pelton, JZ Xu, ... Journal of medicinal chemistry 50 (16), 3954-3963, 2007 | 55 | 2007 |
| Electron density guided fragment-based lead discovery of ketohexokinase inhibitors AC Gibbs, MC Abad, X Zhang, BA Tounge, FA Lewandowski, GT Struble, ... Journal of medicinal chemistry 53 (22), 7979-7991, 2010 | 51 | 2010 |
| NMR solution structure of the precursor for carnobacteriocin B2, an antimicrobial peptide from Carnobacterium piscicola Implications of the α‐helical leader section … T Sprules, KE Kawulka, AC Gibbs, DS Wishart, JC Vederas European Journal of Biochemistry 271 (9), 1748-1756, 2004 | 51 | 2004 |
| Synthesis and structure–activity relationships of thiadiazole-derivatives as potent and orally active peroxisome proliferator-activated receptors α/δ dual agonists L Shen, Y Zhang, A Wang, E Sieber-McMaster, X Chen, P Pelton, JZ Xu, ... Bioorganic & medicinal chemistry 16 (6), 3321-3341, 2008 | 46 | 2008 |
| Inhibitors of ketohexokinase: discovery of pyrimidinopyrimidines with specific substitution that complements the ATP-binding site BE Maryanoff, JC O'Neill, DF McComsey, SC Yabut, DK Luci, ... ACS medicinal chemistry letters 2 (7), 538-543, 2011 | 41 | 2011 |
| Design, Synthesis, and Biological Evaluation of (2 R, α S)-3, 4-Dihydro-2-[3-(1, 1, 2, 2-tetrafluoroethoxy) phenyl]-5-[3-(trifluoromethoxy)-phenyl]-α-(trifluoromethyl)-1 (2 H … GH Kuo, T Rano, P Pelton, KT Demarest, AC Gibbs, WV Murray, ... Journal of medicinal chemistry 52 (6), 1768-1772, 2009 | 40 | 2009 |
| Inhibitor bound dengue NS2B-NS3pro reveals multiple dynamic binding modes AC Gibbs, R Steele, G Liu, BA Tounge, GT Montelione Biochemistry 57 (10), 1591-1602, 2018 | 38 | 2018 |
| A cluster-based strategy for assessing the overlap between large chemical libraries and its application to a recent acquisition MFM Engels, AC Gibbs, EP Jaeger, D Verbinnen, VS Lobanov, ... Journal of chemical information and modeling 46 (6), 2651-2660, 2006 | 38 | 2006 |
| Identification of 2-acylaminothiophene-3-carboxamides as potent inhibitors of FLT3 RJ Patch, CA Baumann, J Liu, AC Gibbs, H Ott, J Lattanze, MR Player Bioorganic & medicinal chemistry letters 16 (12), 3282-3286, 2006 | 38 | 2006 |
