Molecular dynamics of fentanyl bound to μ-opioid receptor PFJ Lipiński, M Jarończyk, JC Dobrowolski, J Sadlej Journal of Molecular Modeling 25, 1-17, 2019 | 66 | 2019 |
Fentanyl family at the mu-opioid receptor: uniform assessment of binding and computational analysis PFJ Lipiński, P Kosson, J Matalińska, P Roszkowski, Z Czarnocki, ... Molecules 24 (4), 740, 2019 | 54 | 2019 |
Theoretical studies on tautomerism and IR spectra of pyrazole derivatives M Jarończyk, JC Dobrowolski, AP Mazurek Journal of Molecular Structure: THEOCHEM 673 (1-3), 17-28, 2004 | 45 | 2004 |
Novel molecular targets of antidepressants M Jarończyk, J Walory Molecules 27 (2), 533, 2022 | 25 | 2022 |
Synthesis of imperatorin analogs and their evaluation as acetylcholinesterase and butyrylcholinesterase inhibitors S Granica, AK Kiss, M Jarończyk, JK Maurin, AP Mazurek, Z Czarnocki Archiv der Pharmazie 346 (11), 775-782, 2013 | 18 | 2013 |
Molecular docking studies, biological and toxicity evaluation of dihydroisoquinoline derivatives as potential anticancer agents J Ziemska, A Guśpiel, J Jarosz, A Nasulewicz-Goldeman, J Wietrzyk, ... Bioorganic & Medicinal Chemistry 24 (21), 5302-5314, 2016 | 17 | 2016 |
The molecular interactions of buspirone analogues with the serotonin transporter M Jarończyk, Z Chilmonczyk, AP Mazurek, G Nowak, AW Ravna, ... Bioorganic & medicinal chemistry 16 (20), 9283-9294, 2008 | 17 | 2008 |
Novel 4-aryl-pyrido [1, 2-c] pyrimidines with dual SSRI and 5-HT1A activity: Part 2 F Herold, Ł Izbicki, A Chodkowski, M Dawidowski, M Król, J Kleps, J Turło, ... European journal of medicinal chemistry 44 (11), 4702-4715, 2009 | 16 | 2009 |
The FMO analysis of the molecular interaction of fentanyl derivatives with the μ-opioid receptor M Jarończyk, PFJ Lipiński, JC Dobrowolski, J Sadlej Chemical Papers 71, 1429-1443, 2017 | 12 | 2017 |
New validated HPLC methodology for the determination of (−)-trans-paroxetine and its enantiomer in pharmaceutical formulations with use of ovomucoid chiral … M Lisowska-Kuźmicz, M Kantor-Boruta, A Jończyk, M Jarończyk, ... Analytical and Bioanalytical Chemistry 406, 3697-3702, 2014 | 11 | 2014 |
On isomers and tautomers of Nitro-1-deazapurine: A DFT study M Jarończyk, JC Dobrowolski Journal of Molecular Structure: THEOCHEM 858 (1-3), 77-84, 2008 | 11 | 2008 |
Affinity of fentanyl and its derivatives for the σ 1-receptor PFJ Lipiński, E Szűcs, M Jarończyk, P Kosson, S Benyhe, A Misicka, ... Medchemcomm 10 (7), 1187-1191, 2019 | 10 | 2019 |
The 1-deazapurine derivatives, tautomerism, substituent effect, and aromaticity: A computational study M Jarończyk, JC Dobrowolski Computational and Theoretical Chemistry 974 (1-3), 9-15, 2011 | 10 | 2011 |
In silico screening for novel leucine aminopeptidase inhibitors with 3, 4-dihydroisoquinoline scaffold J Ziemska, J Solecka, M Jarończyk Molecules 25 (7), 1753, 2020 | 9 | 2020 |
Tautomerism of 1, 3-diphospholes: A DFT study M Jarończyk, JC Dobrowolski, AP Mazurek Chemical physics letters 406 (1-3), 173-178, 2005 | 8 | 2005 |
Conformation of six fentanyls revisited PFJ Lipiński, M Jarończyk, S Ostrowski, JC Dobrowolski, J Sadlej Computational and Theoretical Chemistry 1086, 18-24, 2016 | 6 | 2016 |
Synthesis, in vitro binding studies and docking of long-chain arylpiperazine nitroquipazine analogues, as potential serotonin transporter inhibitors M Jarończyk, K Wołosewicz, M Gabrielsen, G Nowak, I Kufareva, ... European journal of medicinal chemistry 49, 200-210, 2012 | 6 | 2012 |
Structural Insights into σ1 Receptor Interactions with Opioid Ligands by Molecular Dynamics Simulations M Kurciński, M Jarończyk, PFJ Lipiński, JC Dobrowolski, J Sadlej Molecules 23 (2), 456, 2018 | 5 | 2018 |
Oncotoxic Properties of Serotonin Transporter Inhibitors and 5-HT1A Receptor Ligands J Walory, L Mielczarek, M Jarończyk, M Koronkiewicz, J Kossakowski, ... International Journal of Molecular Sciences 19 (10), 3260, 2018 | 4 | 2018 |
QSAR, docking studies and toxicology prediction of isoquinoline derivatives as leucine aminopeptidase inhibitors J Ziemska, J Solecka, M Jarończyk Chemical Papers 71, 2557-2568, 2017 | 4 | 2017 |