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Computational Study of Pt(IV) Complexes with Antitumoral Potential: Assessment of Standard Reduction Potential
Vol 21, 2021 -141810 -
COMPUTATIONAL STUDY OF REDUCTION POTENTIAL OF Ru(III)/Ru(II) COMPLEXES
Vol 21, 2021 -141840 -
PREDICTING FIRST HYPERPOLARIZABILITY OF RUTHENIUM COMPLEXES WITH POTENCIAL TECHNOLOGICAL APPLICATION
Vol 21, 2021 -141788 -
PREDICTING Pt-195 NMR CHEMICAL SHIFT IN Pt(II)-Sn(II) COMPLEXES WITH POTENTIAL CATALYSTIC APPLICATION
Vol 21, 2021 -141799 -
Relativistic Computational Study of Aquation Reaction of Cisplatin
Vol 21, 2021 -141808
Publicações em outros proceedings
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SBQT 2023
PROPOSITION OF CANDIDATES FOR SARS-CoV-2 Mpro INHIBITORS BASED ON MOLECULAR MODELING OF THIAZOLES
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SBQT 2023
Assessment of a computational protocol to predict the standard reduction potential of Fe(III) complexes
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SBQT 2023
Predicting Pt-195 NMR chemical shift in Pt(II) complexes using the new NMR-ZORA basis sets
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SBQT 2023
Computational study of the Tc-99 NMR chemical shift
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SBQT 2023
Predicting 49Ti, 51V, and 57Fe NMR chemical shifts using the new NMR-DKH basis sets
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