Synthesis, structural, equilibrium, anticancer, DNA binding, and computational investigation of binary and ternary palladium(II) complexes based on N-(2-hydroxyethyl)ethylenediamine (2025) Ragab MS, Shoukry MM, El-Madany HM, Haukka M, van Eldik R, Khalf-Alla PA Journal article Host-guest complexes of two imine based isomeric {2}-Lehn-type cryptands: prediction of ion selectivity by quantum chemical calculations XIX* (2025) Adel A, Puchta R, Ćoćić D, Kolenović Serezlić M, Soldatović T, van Eldik R Journal article Anion-π-interaction–a valuable connection in supramolecular chemistry (2025) Ćoćić D, Đorđević S, Radenković S, Puchta R Journal article The ion selectivity of the Goedken-Peng cryptand: prediction of ion selectivity by quantum chemical calculations XVII (2024) Jörg J, Puchta R, Soldatović T, Kolenović Serezlić M, van Eldik R Journal article Hybridization makes the difference: [2Oxa.2Oxa.2Oxa] a sp2-Carbon dominated Lehn-type cryptand - Prediction of ion selectivity by quantum chemical calculations. XVIII (2024) Capponi T, Bason C, Ćoćić D, Puchta R, van Eldik R Journal article Host-guest complexes of a cryptand based on 5H-cyclopenta[2,1-b:3,4b′]pyridine moieties: prediction of ion selectivity by quantum chemical calculations XVI (2023) Capponi T, Weigel J, Ćoćić D, Alzoubi BM, van Eldik R, Puchta R Journal article Synthesis, equilibrium, DFT, and docking studies of a homopiperazine complex with dibutyltin(IV) (2023) Khalaf-Alla PA, Shoukry MM, Shehata MR, Abdel Wahab AM, van Eldik R Journal article Mechanistic insight on the water exchange mechanism of [Zn(tren)H2O](2+) and related complexes from a DFT study (2022) Alzoubi B, Cocic D, Puchta R, van Eldik R Journal article Tuning the lability of a series of Ru(II) polypyridyl complexes: a comparison of experimental-kinetic and DFT-predicted reaction mechanisms (2021) Cocic D, Chrzanowska M, Katafias A, Puchta R, van Eldik R Journal article Noble guests in organic cages–encapsulation of noble gases by cryptophane (2020) Ćoćić D, Puchta R, van Eldik R Journal article