关注
Filipe Menezes
Filipe Menezes
Helmholtz Munich
在 helmholtz-munich.de 的电子邮件经过验证
标题
引用次数
引用次数
年份
Local complete active space second-order perturbation theory using pair natural orbitals (PNO-CASPT2)
F Menezes, D Kats, HJ Werner
The Journal of Chemical Physics 145 (12), 2016
1062016
Methods for the analysis of complex fluorescence decays: Sum of Becquerel functions versus sum of exponentials
F Menezes, A Fedorov, C Baleizao, B Valeur, MN Berberan-Santos
Methods and applications in fluorescence 1 (1), 015002, 2013
412013
Isocyanide complexes with platinum and palladium and their reactivity toward cycloadditions with nitrones to form aminooxycarbenes: A theoretical study
FMC Menezes, ML Kuznetsov, AJL Pombeiro
Organometallics 28 (22), 6593-6602, 2009
332009
Silmitasertib (CX-4945), a clinically used CK2-kinase inhibitor with additional effects on GSK3β and DYRK1A kinases: A structural perspective
P Grygier, K Pustelny, J Nowak, P Golik, GM Popowicz, O Plettenburg, ...
Journal of medicinal chemistry 66 (6), 4009-4024, 2023
272023
MISATO: machine learning dataset of protein–ligand complexes for structure-based drug discovery
T Siebenmorgen, F Menezes, S Benassou, E Merdivan, K Didi, ...
Nature Computational Science, 1-12, 2024
142024
ULYSSES: An Efficient and Easy to Use Semiempirical Library for C++
F Menezes, GM Popowicz
Journal of Chemical Information and Modeling 62 (16), 3685-3694, 2022
122022
Anion binding by fluorescent ureido-hexahomotrioxacalix [3] arene receptors: An NMR, absorption and emission spectroscopic study
AS Miranda, PM Marcos, JR Ascenso, MN Berberan-Santos, F Menezes
Molecules 27 (10), 3247, 2022
92022
Acid Rain and Flue Gas: Quantum Chemical Hydrolysis of NO2
F Menezes, GM Popowicz
ChemPhysChem 23 (21), e202200395, 2022
82022
Synthesis and Chemiluminescence Studies of Luminol and Derivatives
FMC Menezes
MSc. Dissertation, Technical University of Lisboa, Spain, 2010
52010
How to Catch the Ball: Fullerene Binding to the Corannulene Pincer
F Menezes, GM Popowicz
Molecules 27 (12), 3838, 2022
42022
A local complete active space 2nd-order perturbation theory method
F Menezes
Universitätsbibliothek der Universität Stuttgart, 2016
32016
Can Quantum Chemistry Improve the understanding of Protein-Ligand Interactions? Implications for Structure Based Drug Discovery
F Menezes, T Fröhlich, GM Popowicz
bioRxiv, 2023.06. 01.543295, 2023
22023
Structural perspective on the design of selective DYRK1B inhibitors
P Grygier, K Pustelny, F Menezes, M Jemiola-Rzeminska, P Suder, ...
bioRxiv, 2022.12. 23.521429, 2022
22022
SARS-CoV-2 Mpro oligomerization as a potential target for therapy
K Lis, J Plewka, F Menezes, E Bielecka, Y Chykunova, K Pustelny, ...
International Journal of Biological Macromolecules 267, 131392, 2024
12024
Quantum Chemistry in a Pocket: A Multifaceted Tool to Link Structure and Activity
F Menezes, GM Popowicz, T Froehlich, V Napolitano, S Rioton, ...
bioRxiv, 2024.04. 22.590615, 2024
12024
A Buckycatcher in Solution—A Computational Perspective
F Menezes, GM Popowicz
Molecules 28 (6), 2841, 2023
12023
Exploring Novel GSK-3β Inhibitors for Anti-Neuroinflammatory and Neuroprotective Effects: Synthesis, Crystallography, Computational Analysis, and Biological Evaluation
I Góral, T Wichur, E Sługocka, P Grygier, M Głuch-Lutwin, B Mordyl, ...
ACS Chemical Neuroscience, 2024
2024
Corrigendum to" SARS-CoV-2 Mpro oligomerization as a potential target for therapy"[Int. J. Biol. Macromol. 267 (Part 1)(May 2024) 131392]
K Lis, J Plewka, F Menezes, E Bielecka, Y Chykunova, K Pustelny, ...
International journal of biological macromolecules 276 (Pt 1), 133473, 2024
2024
Moderne Medikamentenentwicklung durch den Einbezug künstlicher Intelligenz
T Seibt, F Menezes, R Kurzrock, G Popowicz, A Wahida
InFo Hämatologie+ Onkologie 27 (5), 22-25, 2024
2024
Correction: Miranda et al. Anion Binding by Fluorescent Ureido-Hexahomotrioxacalix [3] arene Receptors: An NMR, Absorption and Emission Spectroscopic Study. Molecules 2022, 27 …
AS Miranda, PM Marcos, JR Ascenso, MN Berberan-Santos, F Menezes
Molecules 29 (8), 1892, 2024
2024
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