COX Inhibition Profile and Molecular Docking Studies of Some 2-(Trimethoxyphenyl)-Thiazoles O Smaranda Dafina, P Liliana, S Cristina Ioana, P Mariana Doina, ... Molecules 22 (9), 1507, 2017 | 61 | 2017 |
Combined molecular docking and QSAR study of fused heterocyclic herbicide inhibitors of D1 protein in photosystem II of plants S Funar-Timofei, A Borota, L Crisan Molecular diversity 21 (2), 437-454, 2017 | 36 | 2017 |
MTD− PLS: A PLS Variant of the Minimal Topologic Difference Method. III. Mapping Interactions between Estradiol Derivatives and the Alpha Estrogenic Receptor L Kurunczi, E Seclaman, TI Oprea, L Crisan, Z Simon Journal of chemical information and modeling 45 (5), 1275-1281, 2005 | 30 | 2005 |
New Efficient Adsorbent Materials for the Removal of Cd(II) from Aqueous Solutions A Visa, B Maranescu, L Lupa, L Crisan, A Borota Nanomaterials 10 (5), 899, 2020 | 28 | 2020 |
Diarylthiazole and diarylimidazole selective COX-1 inhibitor analysis through pharmacophore modeling, virtual screening, and DFT-based approaches L Crisan, A Borota, A Bora, L Pacureanu Structural Chemistry 30, 2311-2326, 2019 | 21 | 2019 |
A quantitative structure–activity relationships study for the anti-HIV-1 activities of 1-[(2-hydroxyethoxy) methyl]-6-(phenylthio) thymine derivatives using the multiple linear … D Ivan, L Crisan, S Funar-Timofei, M Mracec Journal of the Serbian Chemical Society 78 (4), 495, 2013 | 21 | 2013 |
Synthesis and QSRR Study for a Series of Phosphoramidic Acid Derivatives M Petric, L Crisan, M Crisan, A Micle, B Maranescu, G Ilia Heteroatom Chemistry 24, 138-145, 2013 | 20 | 2013 |
Ecotoxicological QSARs K Roy Humana Press, 2020 | 19 | 2020 |
ColBioS-FlavRC: A collection of bioselective flavonoids and related compounds filtered from high-throughput screening outcomes SI Avram, LM Pacureanu, A Bora, L Crisan, S Avram, L Kurunczi Journal of Chemical Information and Modeling 54 (8), 2360-2370, 2014 | 17 | 2014 |
QSAR study and molecular docking on indirubin inhibitors of Glycogen Synthase Kinase-3 L Crisan, L Pacureanu, A Bora, S Avram, L Kurunczi, Z Simon Central European Journal of Chemistry 11 (1), 63-77, 2013 | 17 | 2013 |
Pharmacophore-based screening and drug repurposing exemplified on glycogen synthase kinase-3 inhibitors L Crisan, S Avram, L Pacureanu Molecular Diversity 21, 385-405, 2017 | 16 | 2017 |
Retrospective group fusion similarity search based on eROCE evaluation metric. S Avram, L Crisan, A Bora, L Pacureanu, S Avram, L Kurunczi Bioorg Med Chem, 2013 | 16 | 2013 |
Combined Experimental and Theoretical Insights into the Corrosion Inhibition Activity on Carbon Steel Iron of Phosphonic Acids A Visa, N Plesu, B Maranescu, G Ilia, A Borota, L Crisan Molecules 26 (1), 2021 | 13 | 2021 |
PLS and shape-based similarity analysis of maleimides–GSK-3 inhibitors L Crisan, L Pacureanu, S Avram, A Bora, S Avram, L Kurunczi Journal of enzyme inhibition and medicinal chemistry 29 (4), 599-610, 2014 | 13 | 2014 |
Small molecules of natural origin as potential anti-HIV agents: a computational approach L Crisan, A Bora Life 11 (7), 722, 2021 | 10 | 2021 |
Virtual screening and drug repurposing experiments to identify potential novel selective MAO-B inhibitors for Parkinson’s disease treatment L Crisan, D Istrate, A Bora, L Pacureanu Molecular Diversity, 2020 | 10 | 2020 |
Portraying the selectivity of GSK-3 inhibitors towards CDK-2 by 3D similarity and molecular docking L Pacureanu, S Avram, A Bora, L Kurunczi, L Crisan Structural Chemistry 30 (3), 911-923, 2019 | 7 | 2019 |
Structure-flammability relationship study of phosphoester dimers by MLR and PLS L Crisan, S Iliescu, S Funar-Timofei Polímeros 26 (2), 129-136, 2016 | 6 | 2016 |
In silico study of some natural flavonoids as potential agents against COVID-19: preliminary results A Bora, L Pacureanu, L Crisan Chemistry Proceedings 3 (1), 25, 2021 | 5 | 2021 |
Theoretical investigations of quercetin and its analogues as anticancer agents A Bora, S Avram, L Crisan, L Halip, R Curpan, L Pacureanu, I Ciucanu Rev. Roum. Chim 60 (2-3), 175-181, 2015 | 5 | 2015 |