Revealing monoamine oxidase B catalytic mechanisms by means of the quantum chemical cluster approach G Zapata-Torres, A Fierro, G Barriga-González, JC Salgado, ... Journal of Chemical Information and Modeling 55 (7), 1349-1360, 2015 | 51 | 2015 |
Experimental and theoretical comparison of transition-metal and actinide tetravalent Schiff base coordination complexes BE Klamm, CJ Windorff, C Celis-Barros, ML Marsh, DS Meeker, ... Inorganic Chemistry 57 (24), 15389-15398, 2018 | 46 | 2018 |
Compression of curium pyrrolidine-dithiocarbamate enhances covalency JM Sperling, EJ Warzecha, C Celis-Barros, DC Sergentu, X Wang, ... Nature 583 (7816), 396-399, 2020 | 40 | 2020 |
Electronic structure and properties of berkelium iodates MA Silver, SK Cary, AJ Garza, RE Baumbach, AA Arico, GA Galmin, ... Journal of the American Chemical Society 139 (38), 13361-13375, 2017 | 40 | 2017 |
Origin of selectivity of a triazinyl ligand for americium (III) over neodymium (III) D Dan, C Celis‐Barros, FD White, JM Sperling, TE Albrecht‐Schmitt Chemistry–A European Journal 25 (13), 3248-3252, 2019 | 38 | 2019 |
Synthesis, spectroscopy, and theoretical details of uranyl Schiff-base coordination complexes BE Klamm, CJ Windorff, C Celis-Barros, ML Marsh, TE Albrecht-Schmitt Inorganic Chemistry 59 (1), 23-31, 2019 | 32 | 2019 |
Examination of structure and bonding in 10-coordinate europium and americium terpyridyl complexes FD White, AN Gaiser, EJ Warzecha, JM Sperling, C Celis-Barros, ... Inorganic Chemistry 57 (20), 12969-12975, 2018 | 31 | 2018 |
Trivalent f-element squarates, squarate-oxalates, and cationic materials, and the determination of the nine-coordinate ionic radius of Cf (III) N Brenner, JM Sperling, TN Poe, C Celis-Barros, K Brittain, EM Villa, ... Inorganic Chemistry 59 (13), 9384-9395, 2020 | 25 | 2020 |
Probing a variation of the inverse-trans-influence in americium and lanthanide tribromide tris (tricyclohexylphosphine oxide) complexes CJ Windorff, C Celis-Barros, JM Sperling, NC McKinnon, ... Chemical Science 11 (10), 2770-2782, 2020 | 23 | 2020 |
Understanding the stabilization and tunability of divalent europium 2.2. 2B cryptates TN Poe, MJ Beltrán-Leiva, C Celis-Barros, WL Nelson, JM Sperling, ... Inorganic Chemistry 60 (11), 7815-7826, 2021 | 20 | 2021 |
Molecular dynamics simulation of halogen bonding mimics experimental data for cathepsin L inhibition C Celis-Barros, L Saavedra-Rivas, JC Salgado, BK Cassels, ... Journal of computer-aided molecular design 29, 37-46, 2015 | 18 | 2015 |
Influence of protonation on substrate and inhibitor interactions at the active site of human monoamine oxidase-a G Zapata-Torres, A Fierro, S Miranda-Rojas, C Guajardo, P Saez-Briones, ... Journal of chemical information and modeling 52 (5), 1213-1221, 2012 | 17 | 2012 |
Synthesis, 5-hydroxytryptamine1A receptor affinity and docking studies of 3-[3-(4-aryl-1-piperazinyl)-propyl]-1H-indole derivatives H Pessoa-Mahana, CU Núñez, R Araya-Maturana, CS Barría, ... Chemical and Pharmaceutical Bulletin 60 (5), 632-638, 2012 | 17 | 2012 |
Structure and Characterization of an Americium Bis(O,O’-diethyl)dithiophosphate Complex RDM Greer, C Celis-Barros, JM Sperling, AN Gaiser, CJ Windorff, ... Inorganic Chemistry 59 (22), 16291-16300, 2020 | 16 | 2020 |
Detecting Ni (II) in aqueous solution by 3-(2-pyridyl)-[1, 2, 3] triazolo [1, 5-a] pyridine and dimethyl-β-cyclodextrin C Jullian, S Fernández-Sandoval, M Rojas-Aranguiz, H Gómez-Machuca, ... Carbohydrate polymers 107, 124-131, 2014 | 16 | 2014 |
Molecular and electronic structure, and hydrolytic reactivity of a samarium (II) crown ether complex FD White, C Celis-Barros, J Rankin, E Solís-Céspedes, D Dan, AN Gaiser, ... Inorganic chemistry 58 (5), 3457-3465, 2019 | 15 | 2019 |
Creation of an unexpected plane of enhanced covalency in cerium (III) and berkelium (III) terpyridyl complexes AN Gaiser, C Celis-Barros, FD White, MJ Beltran-Leiva, JM Sperling, ... Nature Communications 12 (1), 7230, 2021 | 14 | 2021 |
Influence of outer-sphere anions on the photoluminescence from samarium (II) crown complexes TN Poe, S Molinari, MJ Beltran-Leiva, C Celis-Barros, H Ramanantoanina, ... Inorganic Chemistry 60 (20), 15196-15207, 2021 | 14 | 2021 |
Exploring the oxidation states of neptunium with Schiff base coordination complexes BE Klamm, CJ Windorff, C Celis-Barros, MJ Beltran-Leiva, JM Sperling, ... Inorganic Chemistry 59 (24), 18035-18047, 2020 | 14 | 2020 |
Electronic, Magnetic, and Theoretical Characterization of (NH4)4UF8, a Simple Molecular Uranium(IV) Fluoride AT Chemey, C Celis-Barros, K Huang, JM Sperling, CJ Windorff, ... Inorganic Chemistry 58 (1), 637-647, 2018 | 14 | 2018 |