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An ONIOM approach for calculating the UV-Vis spectra of warfarin
Vol 21, 2021 -140798 -
Estudo computacional do espectro UV-Vis do calcitriol, principal forma biologicamente ativa da vitamina D
Vol 21, 2021 -141302 -
Cálculos de frequência vibracionais em moléculas diatômicas usando os modelos de osciladores harmônico e anarmônico
Vol 21, 2021 -141538 -
Docking molecular para avaliar a bioatividade d a Estavudina , Grazoprevir, Lamivudina, Oxifenisatina, Remdesivir, Rimantadina e Tenofovir contra a COVID-19
Vol 21, 2021 -140307 -
Brønsted Acid Catalyzed Methoxy to Hydroxy Rearrangements in Isoquinoline Coumpounds
Vol 21, 2021 -140296
Publications in other proceedings
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SBBf-2024
STUDY OF THE ELECTRONIC TRANSITIONS OF TRYPTOPHAN IN THE VITAMIN D RECEPTOR
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SBQT 2023
TD-DFT analysis of tryptophan from the vitamin D receptor binding site
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SBQT 2023
Strategies to Incorporate a Variable Reduced Mass Into Analytical Quantum Tunneling Calculations
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SBQT 2023
Investigação de atividade óptica pela conversão de espectros ECD – ORD com a Transformada de Kramers-Kronig
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SBQT 2023
Quantum Computing and Chemistry: a case study
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