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PUBLICATIONS @ PHARMA-ECO
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Second project year:
PAPER
Ljulj, Antonio; Škibola, Petra; Turkalj, Dora; Vrček, Valerije
N-Chlorination of Sulfonamides: DFT Study of the Reaction Mechanism
The journal of Physical Chemistry A 129 (2025), 11495-11501
doi:10.1021/acs.jpca.5c05059
PAPER
Zubčić, Gabrijel; Andrijanić, Luka; Džeba, Iva; You, Jiangyang; Friganović, Tomislav; Portada, Tomislav; Pavić, Kristina; Bešić, Erim; Vrček, Valerije; Šakić, Davor
Mechanistic Insights into the Propagation Cycle of the Hofmann–Löffler–Freytag Reaction. Halogen vs Hydrogen Atom Transfer
The Journal of Organic Chemistry 90/14 (2025), 4873–4887
doi:10.1021/acs.joc.4c02997
CONFERENCES
Ljulj, Antonio; Vrček, Valerije; Lovrić, Ivana
Environmentally relevant hydrolysis of anticancer drugs explored by DFT calculations.
ESOR2025, 20th European Symposium on Organic Reactivity
Padova: University of Padova, 2025. str. 67-67
CONFERENCES
Vrček, Valerije; Ljulj, Antonio; Lovrić, Ivana; Lončarić, Martin
The effect of light on the N-chlorination of anticancer drugs.
ESOR2025, 20th European Symposium on Organic Reactivity
Padova: University of Padova, 2025. str. 147-147
CONFERENCES - PRESENTATION
Ljulj, Antonio
Environmentally relevant hydrolysis of anticancer drugs explored by DFT calculations.
ESOR2025, 20th European Symposium on Organic Reactivity
Padova: University of Padova, 2025. str. 67-67
CONFERENCES
Ljulj, Antonio; Lovrić, Ivana; Vujević, Jerko; Vuljanković, Edi; Lončarić, Martin; Vrček, Valerije
Hydrolysis of environmentally relevant anticancer drugs monitored by NMR spectroscopy.
Adriatic NMR conference 2025
Vodice: Croatian Chemical Society, 2025. str. 46-46
CONFERENCES - PRESENTATION
Vrček, Valerije; Ljulj, Antonio; Lovrić, Ivana; Vujević, Jerko; Vuljanković, Edi; Lončarić, Martin
Environmentally relevant transformations of pharmaceuticals followed by NMR spectroscopy.
Adriatic NMR conference 2025
Vodice: Croatian Chemical Society, 2025. str. 25-25
CONFERENCES
Škibola, Petra; Turkalj, Dora; Ljulj, Antonio; Vrček, Valerije
Kako se klorira sulfametoksazol? Računalni odgovor na ekološko pitanje.
11. simpozij studenata farmacije i medicinske biokemije, FARMEBS 2025
Zagreb: Sveučilište u Zagrebu, Farmaceutsko-biokemijski fakultet, 2025. str. 67-67
CONFERENCES
Lovrić, Ivana; Ljulj, Antonio; Vrček, Valerije
Reakcije pregrađivanja ciklofosfamida i ifosfamida u vodi.
11. simpozij studenata farmacije i medicinske biokemije, FARMEBS 2025
Zagreb: Sveučilište u Zagrebu, Farmaceutsko-biokemijski fakultet, 2025. str. 55-55
CONFERENCES - PRESENTATION
Šakić, Davor; Ljulj, Antonio; Ulm, Lea; Vrček, Valerije
Chlorinated nucleobases: an unexpected (eco)toxicological profile.
7th International Congress Of The Croatian Society Of Toxicology (CROTOX 2025)
Rab: Hrvatsko toksikološko društvo, 2025. Arhiv za higijenu rada i toksikologiju, 76, 1, 2025. str. 35-36
CONFERENCES - PRESENTATION
Vrček, Valerije
Kemijska sudbina lijekova in silico.
Dani e-infrastrukture Srce DEI 2025
Zagreb: Sveučilišni računalni centar - SRCE, 2025.
CONFERENCES - PRESENTATION
Ljulj, Antonio; Malezan, Lea; Kolympadi Marković, Maria; Marković, Dean; Šakić, Davor; Vrček, Valerije
Computational methods for predicting the pKa of terminal alkynes.
Computational Chemistry Day 2025
Zagreb: Sveučilište u Zagrebu, Farmaceutsko-biokemijski fakultet, 2025. str. 11-11
NEWS ARTICLE
Ljulj, Antonio; Lovrić, Ivana; Malezan, Lea; Škibola, Petra; Turkalj, Darija; Vrček, Valerije
Kemijska sudbina lijekova in silico.
Srce novosti
101, 1, 2025. str. 14-14
CONFERENCE
Vrček, Valerije
Pharmaceuticals in the environment as a bioethical issue.
27th Days of bioethics. Language of medicine: new challenges in research, ethics, and intercultural communication
Rijeka, 2025.
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First project year:
PAPER
Zubčić, Gabrijel; Pavić, Kristina; You, Jiangyang; Vrček, Valerije; Portada, Tomislav; Bešić, Erim; Šakić, Davor
Light-induced rearrangement from macrocyclic to bicyclic lactam: A case study of N-chlorinated laurolactam
Acta Pharmaceutica 74/4 (2024), 725/737
doi:doi.org/10.2478/acph-2024-0035
PAPER
Zubčić, Gabrijel; You, Jiangyang; Zott, Fabian L.; Ashirbaev, Salavat S.; Šakić, Davor; Vrček, Valerije
Regioselective Rearrangement of Nitrogen- and Carbon-Centered Radical Intermediates in the Hofmann−Löffler−Freytag Reaction
The Journal Physical Chemistry A 128/13 (2024), 2574–2583
doi:10.1021/acs.jpca.3c07892
PAPER
Vrček, Valerije
Surprise Chemistry: Pharmaceuticals in the Environment
Science, art and religion 3/3-4 (2024), 76-79
doi:10.5005/jp-journals-11005-0083
CONFERENCES
Vrček, Valerije; Ljulj, Antonio; Celinić, Mateo
CHEMICAL FATE OF ANTICANCER DRUGS. 1H, 13C, AND 31P NMR STUDY OF CHLORINATION OF CYCLOPHOSPHAMIDE AND IFOSFAMIDE.
Central European NMR Symposium & Bruker Users’ Meeting 2024
Rijeka, Hrvatska, 18.09.2024-19.09.2024.
CONFERENCES
Vrček, Valerije; Ljulj, Antonio
CHEMICAL FATE OF PHARMACEUTICALS IN THE ENVIRONMENT: NMR AND QUANTUM-CHEMICAL STUDY.
Humboldt Kolleg "Human and artificial intelligence in science and society
Sofija: Humboldt Union Bulgarien, Bugarska, 2024.
CONFERENCES
Zubčić, Gabrijel ; Pavić, Kristina ; Portada, Tomislav ; You, Jiangyang ; Bešić, Erim ; Vrček, Valerije ; Šakić, Davor
From macrocyclic to bicyclic rings: harnessing light in Hoffman-Löffler-Freytag radical rearrangements.
7th Croatian Congress on Pharmacy with international participation
Dubrovnik, Croatia, 2024.
