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Articles with tag Drug Discovery and Drug Delivery Systems

Ligands docking to ORF8 by co-evolution. Could they reduce the inflammation levels induced by SARS-COV-2 infections?

23 November 2023 by Melissa Bello-perez and Julio Coll

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Traversing Chemical Space with Active Deep Learning

23 November 2023 by Derek Van Tilborg and Francesca Grisoni at

Princeton University

Biological and Medicinal Chemistry, Bioinformatics and Computational Biology

Using Machine Learning to Predict the Antibacterial Activity of Ruthenium Complexes

23 November 2023 by Markus Orsi and others at

National University of Singapore

Biological and Medicinal Chemistry, Organometallic Chemistry

Patient-derived Immunocompetent Tumor Organoids: A Platform for Chemotherapy Evaluation in the Context of T-cell Recognition

20 November 2023 by Zihan Zhao and others at Nanjing University

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Bioisosteres at C9 of 2,3-didehydro-5-N-acetyl neuraminic acid identify selective inhibitors of NEU3

20 November 2023 by Mostafa Radwan and Christopher Cairo at

University of Alberta

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Therapeutic peptides are preferentially solubilized in specific microenvironments within PEG-PLGA polymer nanoparticles

15 November 2023 by Raquel Lopez-rios De Castro and others at

King's College London

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Synthesis of α3β4 Nicotinic Acetylcholine Receptor Modulators Derived from Aristoquinoline that Reduce Reinstatement of Cocaine-Seeking Behavior

15 November 2023 by Lisa Rusali and others

Biological and Medicinal Chemistry, Organic Chemistry

Design, Synthesis and Biological Evaluation of Chalcone Acetamide Derivatives against Triple Negative Breast Cancer

14 November 2023 by Puneet Kumar and others

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

ESSENCE-Dock: A Consensus-Based Approach to Enhance Virtual Screening Enrichment in Drug Discovery

14 November 2023 by Jochem Nelen and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Bioisosteres at C9 of 2,3-didehydro-5-N-acetyl neuraminic acid identify selective inhibitors of NEU3

14 November 2023 by Mostafa Radwan and Christopher Cairo at

University of Alberta

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Design, synthesis, and biological characterization of proteolysis targeting chimera (PROTACs) for the Ataxia telangiectasia and RAD3-related (ATR) kinase

10 November 2023 by Abdallah Alfayomy and others at

Mainz Institute for Theoretical Physics

Biological and Medicinal Chemistry, Cell and Molecular Biology

Synthesis and Structural Optimization of ATG4B Inhibitors for the Attenuation of Treatment-Induced Autophagy in Glioblastoma

10 November 2023 by Karl Scheidt and others at

Northwestern University

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Prediction of Drug Distribution to Each Tissue Using Random Forest Twice with In Vitro Experimental Values and Predicted Kp Values of Other Tissues

9 November 2023 by Koichi Handa and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Consensus screening for a challenging target: the quest for P-glycoprotein inhibitors

8 November 2023 by Paolo Governa and others at

Scripps Research Institute

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Traversing Chemical Space with Active Deep Learning

8 November 2023 by Derek Van Tilborg and Francesca Grisoni at

Princeton University

Biological and Medicinal Chemistry, Bioinformatics and Computational Biology

Design and synthesis of 4-amino-2’,4’-dihydroxyindanone derivatives as potent inhibitors of tyrosinase and melanin biosynthesis in human melanoma cells

8 November 2023 by Leticia Lazinski and others at Marseille

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

REINVENT4: Modern AI–Driven Generative Molecule Design

6 November 2023 by Hannes Loeffler and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Metabolomic Analysis and SARS-CoV-2 Antiviral Screening of Marine Cyanobacterial Library Identify Jobosnoic Acid, an Unreported Virus-selective Fatty Acid Inhibitor.

6 November 2023 by Marie Matos-hernández and others

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

A Perspective on Covalent Inhibitors: Research and Development Trends of Warheads and Targets

6 November 2023 by Haitao Chen and others

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Compounds from Morchella esculenta as Potential Inhibitors of RNA-Binding Protein La in Ovarian Cancer: A Molecular Modeling and Quantum Mechanics Approach

3 November 2023 by Gbenga Dairo and others at

Western Illinois University

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Synthesis of 15N-Pyridines and Higher Mass Isotopologs via Zincke Imine Intermediates

2 November 2023 by Hillary M. H. Nguyen and others at

Colorado State University

Biological and Medicinal Chemistry, Organic Chemistry

Finding for New Drugs in Nature for Neglected Tropical Diseases: In Silico Study of Homolycorine Alkaloids against Chagas Disease

31 October 2023 by Daniel Mora and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Resiniferatoxin: Mechanism in Treating Osteoarthritis Pain and Slowing Osteoarthritis Progression, Safety, and Efficacy

31 October 2023 by David Liu

Biological and Medicinal Chemistry, Organic Chemistry

Exploring the Effect of Temperature on the Concentration of Salicylic Acid in Acetylsalicylic Acid

30 October 2023 by Rojina Karimirad at Editors

Biological and Medicinal Chemistry, Organic Chemistry

Scoring Methods in Lead Optimization of Molecular Glues

30 October 2023 by Lei Jia and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Insulin–Dendrimer Nanocomplex for Multi-Day Glucose-Responsive Therapy in Mice and Swine

30 October 2023 by Sijie Xian and others at

University of Notre Dame

Biological and Medicinal Chemistry, Drug Discovery and Drug Delivery Systems

Poacic Acid, a Plant-Derived Stilbenoid, Augments Cell-Wall Chitin Production, but Its Antifungal Activity Is Hindered by this Polysaccharide and by Fungal Essential Metals

27 October 2023 by Adi Yona and Micha Fridman at

Tel Aviv University

Biological and Medicinal Chemistry, Chemical Biology

Molecular Exchange in Lipid Nanoparticles via Time-Resolved Small Angle Neutron Scattering

26 October 2023 by Shayna Hilburg and others at

University of Washington

Physical Chemistry, Biological and Medicinal Chemistry

Scoring Methods in Lead Optimization of Molecular Glues

25 October 2023 by Lei Jia and others

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry

Elion: A Deep Learning Based Platform for Multi-Objective Drug Hit Optimization

25 October 2023 by Gustavo Seabra and Chenglong Li at

University of Florida

Theoretical and Computational Chemistry, Biological and Medicinal Chemistry