Search Results - "Vulpetti A"

Author Correction: DCAF1-based PROTACs with activity against clinically validated targets overcoming intrinsic- and acquired-degrader resistance.

Authors: Schröder M Renatus M Liang X et al.

Source: Nature communications [Nat Commun] 2024 Aug 19; Vol. 15 (1), pp. 7109. Date of Electronic Publication: 2024 Aug 19.

Publication Type: Published Erratum

Journal Info: Publisher: Nature Pub. Group Country of Publication: England NLM ID: 101528555 Publication Model: Electronic Cited Medium: Internet ISSN: 2041-1723 (Electronic) Linking ISSN: 20411723 NLM ISO Abbreviation: Nat Commun Subsets: MEDLINE; PubMed not MEDLINE

QM assisted ML for 19F NMR chemical shift prediction.

Authors: Penner, Patrick Vulpetti, Anna

Source: Journal of Computer-Aided Molecular Design; Dec2024, Vol. 38 Issue 1, p1-15, 15p

Dual-LAO for calculating fast and robust relative binding free energies of simple and complex transformations.

Authors: Ansari, Narjes Aviat, Félix Hénin, Jérôme et al.

Source: Communications Chemistry. 5/8/2026, Vol. 9 Issue 1, p1-11. 11p.

Molecular Docking and Pharmacokinetic Profiling of GC-MS-Identified Phytochemicals from Peganum harmala -Derived Essential Oil: In Silico Assessment of Binding Affinity Toward PCOS-Related Targets.

Authors: Al-Otaibi, Waad A. AlMotwaa, Sahar M.

Source: Applied Sciences (2076-3417); May2026, Vol. 16 Issue 9, p4214, 28p

Molecular docking and MD simulations predicted quercetin as a potent human interleukin-1 beta (hIL1β) inhibitor for improved endodontic disease management.

Authors: Boreak, Nezar Almasoudi, Shroog Ali Alharbi, Abdulelah et al.

Source: PLoS ONE. 12/10/2025, Vol. 20 Issue 12, p1-17. 17p.

Flexor Tendon Continuity and Negative X-ray: The "Combo" Negative Features in Finger Subamputation.

Authors: Pugliese, Pierfrancesco Vulpetti, Mariangela Tondini, Greta et al.

Source: Journal of Clinical Medicine. Jun2024, Vol. 13 Issue 11, p3331. 8p.

Author Index.

Source: Acta Ophthalmologica (1755375X). Dec2018 Supplement S261, Vol. 96 Issue 261, p144-150. 7p.

Combined Surgically Induced Macular Detachment and Autologous Internal Limiting Membrane Transplantation for Refractory Full Thickness Macular Hole.

Authors: Frisina, Rino Di Leo, Laura Gallo Afflitto, Ilenia et al.

Source: Journal of Clinical Medicine. Mar2025, Vol. 14 Issue 6, p2123. 10p.

Benchmarking deep learning models for predicting anticancer drug potency (IC50) with insights for medicinal chemists.

Authors: Garai, Udbhas Pal, Aditya S. Ghosh, Koyel et al.

Source: Communications Chemistry. 1/29/2026, Vol. 9 Issue 1, p1-11. 11p.

Trends in Flight-Operated Small-Satellite Propulsion Technologies.

Authors: Shumeiko, Andrei Fedorova, Daria Egoshin, Denis et al.

Source: Applied Sciences (2076-3417); Mar2026, Vol. 16 Issue 6, p2939, 42p

Inside Cover: Comprehensive and High‐Throughput Exploration of Chemical Space Using Broadband ¹⁹F NMR‐Based Screening (Angew. Chem. Int. Ed. 35/2020).

Authors: Lingel, Andreas Vulpetti, Anna Reinsperger, Tony et al.

Source: Angewandte Chemie International Edition. 8/24/2020, Vol. 59 Issue 35, p14698-14698. 1p.

Innentitelbild: Comprehensive and High‐Throughput Exploration of Chemical Space Using Broadband ¹⁹F NMR‐Based Screening (Angew. Chem. 35/2020).

Authors: Lingel, Andreas Vulpetti, Anna Reinsperger, Tony et al.

Source: Angewandte Chemie. 8/24/2020, Vol. 132 Issue 35, p14806-14806. 1p.

OICR-41103 as a chemical probe for the DCAF1 WD40 domain.

Authors: Kimani, Serah W. Noureldin, Mahmoud Wilson, Brian et al.

Source: Communications Biology. 7/19/2025, Vol. 8 Issue 1, p1-12. 12p.

Frags2Drugs: A Novel In Silico Fragment-Based Approach to the Discovery of Kinase Inhibitors.

Authors: Peyrat, Gautier Bournez, Colin Krezel, Pascal et al.

Source: Pharmaceuticals (14248247). Feb2026, Vol. 19 Issue 2, p308. 24p.

Long-Lived States Involving a Manifold of Fluorine-19 Spins in Fluorinated Aliphatic Chains.

Authors: Wiame, Coline Dyck, Sebastiaan Van Sheberstov, Kirill et al.

Source: Magnetic Resonance. 6/19/2025, p1-11. 11p.

Beyond IC50—A computational dynamic model of drug resistance in enzyme inhibition treatment.

Authors: Roadnight Sheehan, J. de Wijn, Astrid S. Freire, Thales Souza et al.

Source: PLoS Computational Biology. 11/7/2024, Vol. 20 Issue 11, p1-27. 27p.

QM assisted ML for ¹⁹F NMR chemical shift prediction.

Authors: Penner, Patrick Vulpetti, Anna

Source: Journal of Computer-Aided Molecular Design. Dec2024, Vol. 38 Issue 1, p1-15. 15p.

A multi-modal co-attention model for accurate drug-target interaction prediction.

Authors: Ma, Wanjun Li, Wenjun Yang, Mengyun et al.

Source: PLoS ONE. 6/22/2026, Vol. 21 Issue 6, p1-17. 17p.

Monitoring Photo‐Depolymerization of Polyethylene Terephthalate Using Time‐Resolved Diffusion NMR on a Benchtop Spectrometer.

Authors: Khalid, Farwa Malangi Gajendramurthy, Chunchesh Choińska, Emilia et al.

Source: Chemistry - Methods. May2026, Vol. 6 Issue 5, p1-8. 8p.

In situ tracking ion-exchange during Li⁺/Na⁺/K⁺ substitution: Bipolar disorder treatment through drug delivery system.

Alternate Title: Seguimiento in situ del intercambio iónico durante la sustitución de Li+/Na+/K+: Tratamiento del trastorno bipolar mediante un sistema de administración de fármacos.
Rastreamento in situ da troca iônica durante a substituição de Li+/Na+/K+: Tratamento do transtorno bipolar por meio de sistemas de liberação de fármacos.

Authors: Mollaamin, Fatemeh Monajjemi, Majid

Source: Revista Colombiana de Ciencias Químico-Farmacéuticas. 2026, Vol. 55 Issue 2, p458-476. 19p.