Integrated modeling program, applied chemical theory (IMPACT) JL Banks, HS Beard, Y Cao, AE Cho, W Damm, R Farid, AK Felts, ... Journal of computational chemistry 26 (16), 1752-1780, 2005 | 1452 | 2005 |
Importance of accurate charges in molecular docking: quantum mechanical/molecular mechanical (QM/MM) approach AE Cho, V Guallar, BJ Berne, R Friesner Journal of computational chemistry 26 (9), 915-931, 2005 | 463 | 2005 |
Extension of QM/MM docking and its applications to metalloproteins AE Cho, D Rinaldo Journal of Computational Chemistry 30 (16), 2609-2616, 2009 | 80 | 2009 |
Influence of ionic liquid and ionic salt on protein against the reactive species generated using dielectric barrier discharge plasma P Attri, T Sarinont, M Kim, T Amano, K Koga, AE Cho, E Ha Choi, ... Scientific reports 5 (1), 17781, 2015 | 77 | 2015 |
Highly l and d enantioselective variants of horseradish peroxidase discovered by an ultrahigh-throughput selection method E Antipov, AE Cho, KD Wittrup, AM Klibanov Proceedings of the National Academy of Sciences 105 (46), 17694-17699, 2008 | 75 | 2008 |
Re‐engineering the immune response to metastatic cancer: antibody‐recruiting small molecules targeting the urokinase receptor AF Rullo, KJ Fitzgerald, V Muthusamy, M Liu, C Yuan, M Huang, M Kim, ... Angewandte Chemie 128 (11), 3706-3710, 2016 | 72 | 2016 |
Molecular insights into the adsorption mechanism of human β-defensin-3 on bacterial membranes J Lee, SW Jung, AE Cho Langmuir 32 (7), 1782-1790, 2016 | 72 | 2016 |
Correlation between performance of QM/MM docking and simple classification of binding sites JY Chung, JM Hah, AE Cho Journal of chemical information and modeling 49 (10), 2382-2387, 2009 | 61 | 2009 |
Variation in structure of proteins by adjusting reactive oxygen and nitrogen species generated from dielectric barrier discharge jet JH Park, M Kim, M Shiratani, AE Cho, EH Choi, P Attri Scientific reports 6 (1), 35883, 2016 | 48 | 2016 |
The construction of double-ended classical trajectories AE Cho, JD Doll, DL Freeman Chemical physics letters 229 (3), 218-224, 1994 | 48 | 1994 |
Using reverse docking to identify potential targets for ginsenosides K Park, AE Cho Journal of ginseng research 41 (4), 534-539, 2017 | 44 | 2017 |
The MPSim‐Dock hierarchical docking algorithm: Application to the eight trypsin inhibitor cocrystals AE Cho, JA Wendel, N Vaidehi, PM Kekenes–Huskey, WB Floriano, ... Journal of computational chemistry 26 (1), 48-71, 2005 | 41 | 2005 |
Quantum mechanical scoring for protein docking AE Cho, JY Chung, M Kim, K Park The Journal of chemical physics 131 (13), 2009 | 36 | 2009 |
Ginsenoside Rd inhibits the metastasis of colorectal cancer via epidermal growth factor receptor signaling axis LTH Phi, IN Sari, YT Wijaya, KS Kim, K Park, AE Cho, HY Kwon IUBMB life 71 (5), 601-610, 2019 | 35 | 2019 |
Exploring the ligand efficacy of cannabinoid receptor 1 (CB1) using molecular dynamics simulations SW Jung, AE Cho, W Yu Scientific Reports 8 (1), 13787, 2018 | 35 | 2018 |
Origin and control of polyacrylonitrile alignments on carbon nanotubes and graphene nanoribbons J Lee, JI Choi, AE Cho, S Kumar, SS Jang, YH Kim Advanced Functional Materials 28 (15), 1706970, 2018 | 31 | 2018 |
Synthesis and evaluation of manganese (II)-based ethylenediaminetetraacetic acid–ethoxybenzyl conjugate as a highly stable hepatobiliary magnetic resonance imaging contrast agent MK Islam, S Kim, HK Kim, YH Kim, YM Lee, G Choi, AR Baek, BK Sung, ... Bioconjugate Chemistry 29 (11), 3614-3625, 2018 | 30 | 2018 |
Water pharmacophore: designing ligands using molecular dynamics simulations with water SW Jung, M Kim, S Ramsey, T Kurtzman, AE Cho Scientific Reports 8 (1), 10400, 2018 | 28 | 2018 |
Broken-symmetry unrestricted hybrid density functional calculations on nickel dimer and nickel hydride CV Diaconu, AE Cho, JD Doll, DL Freeman The Journal of chemical physics 121 (20), 10026-10040, 2004 | 28 | 2004 |
Impact of an ionic liquid on protein thermodynamics in the presence of cold atmospheric plasma and gamma rays P Attri, M Kim, EH Choi, AE Cho, K Koga, M Shiratani Physical Chemistry Chemical Physics 19 (37), 25277-25288, 2017 | 23 | 2017 |