| Insight into the cation− π interaction at the metal binding site of the copper metallochaperone CusF DK Chakravorty, B Wang, MN Ucisik, KM Merz Jr Journal of the American Chemical Society 133 (48), 19330-19333, 2011 | 58 | 2011 |
| Discovery of potent thrombin inhibitors from a protease-focused DNA-encoded chemical library S Dawadi, N Simmons, G Miklossy, KM Bohren, JC Faver, MN Ucisik, ... Proceedings of the National Academy of Sciences 117 (29), 16782-16789, 2020 | 49 | 2020 |
| DNA-encoded chemistry technology yields expedient access to SARS-CoV-2 Mpro inhibitors S Chamakuri, S Lu, MN Ucisik, KM Bohren, YC Chen, HC Du, JC Faver, ... Proceedings of the National Academy of Sciences 118 (36), e2111172118, 2021 | 46 | 2021 |
| Discovery and characterization of bromodomain 2–specific inhibitors of BRDT Z Yu, AF Ku, JL Anglin, R Sharma, MN Ucisik, JC Faver, F Li, ... Proceedings of the National Academy of Sciences 118 (9), e2021102118, 2021 | 46 | 2021 |
| Molecular Dynamics Study of Helicobacter pylori Urease MS Minkara, MN Ucisik, MN Weaver, KM Merz Jr Journal of chemical theory and computation 10 (5), 1852-1862, 2014 | 44 | 2014 |
| C–N coupling of DNA-conjugated (hetero) aryl bromides and chlorides for DNA-encoded chemical library synthesis YC Chen, JC Faver, AF Ku, G Miklossy, K Riehle, KM Bohren, MN Ucisik, ... Bioconjugate Chemistry 31 (3), 770-780, 2020 | 43 | 2020 |
| Molecular Dynamics Study of Twister Ribozyme: Role of Mg2+ Ions and the Hydrogen-Bonding Network in the Active Site MN Ucisik, PC Bevilacqua, S Hammes-Schiffer Biochemistry 55 (27), 3834-3846, 2016 | 35 | 2016 |
| Identifying oxacillinase-48 carbapenemase inhibitors using DNA-encoded chemical libraries DM Taylor, J Anglin, S Park, MN Ucisik, JC Faver, N Simmons, Z Jin, ... ACS infectious diseases 6 (5), 1214-1227, 2020 | 32 | 2020 |
| Structure and dynamics of the N-terminal domain of the Cu (I) binding protein CusB MN Ucisik, DK Chakravorty, KM Merz Jr Biochemistry 52 (39), 6911-6923, 2013 | 29 | 2013 |
| Bringing clarity to the prediction of protein–ligand binding free energies via “blurring” MN Ucisik, Z Zheng, JC Faver, KM Merz Journal of Chemical Theory and Computation 10 (3), 1314-1325, 2014 | 27 | 2014 |
| The movable type method applied to protein–ligand binding Z Zheng, MN Ucisik, KM Merz Journal of chemical theory and computation 9 (12), 5526-5538, 2013 | 27 | 2013 |
| Prediction of trypsin/molecular fragment binding affinities by free energy decomposition and empirical scores ML Benson, JC Faver, MN Ucisik, DS Dashti, Z Zheng, KM Merz Journal of computer-aided molecular design 26, 647-659, 2012 | 24 | 2012 |
| Pairwise additivity of energy components in protein-ligand binding: The HIV II protease-indinavir case MN Ucisik, DS Dashti, JC Faver, KM Merz The Journal of chemical physics 135 (8), 2011 | 24 | 2011 |
| Trapping intermediates in metal transfer reactions of the CusCBAF export pump of Escherichia coli KN Chacón, J Perkins, Z Mathe, K Alwan, EN Ho, MN Ucisik, KM Merz, ... Communications Biology 1 (1), 192, 2018 | 23 | 2018 |
| Origins of the diastereoselectivity in hydrogen bonding directed Diels–Alder reactions of chiral dienes with achiral dienophiles: a computational study S Agopcan, N Çelebi-Ölçüm, MN Üçışık, A Sanyal, V Aviyente Organic & Biomolecular Chemistry 9 (23), 8079-8088, 2011 | 20 | 2011 |
| Discovery of potent BET bromodomain 1 stereoselective inhibitors using DNA-encoded chemical library selections RK Modukuri, Z Yu, Z Tan, HM Ta, MN Ucisik, Z Jin, JL Anglin, KL Sharma, ... Proceedings of the National Academy of Sciences 119 (22), e2122506119, 2022 | 19 | 2022 |
| Insights into the mechanistic dichotomy of the protein farnesyltransferase peptide substrates CVIM and CVLS Y Yang, B Wang, MN Ucisik, G Cui, CA Fierke, KM Merz Jr Journal of the American Chemical Society 134 (2), 820-823, 2012 | 18 | 2012 |
| Relative binding free energies of adenine and guanine to damaged and undamaged DNA in human DNA polymerase η: Clues for fidelity and overall efficiency MN Ucisik, S Hammes-Schiffer Journal of the American Chemical Society 137 (41), 13240-13243, 2015 | 17 | 2015 |
| Computer-aided drug design: using numbers to your advantage JC Faver, MN Ucisik, W Yang, KM Merz Jr ACS medicinal chemistry letters 4 (9), 812-814, 2013 | 17 | 2013 |
| Models for the metal transfer complex of the N-terminal region of CusB and CusF MN Ucisik, DK Chakravorty, KM Merz Jr Biochemistry 54 (27), 4226-4235, 2015 | 12 | 2015 |
Kenneth M. Merz Jr.University Distinguished Professor and Joseph Zichis Chair in Chemistry, Michigan State UniversityVerified email at msu.edu
