Search Result "<i>de novo</i> ligand design"


Research Article

In silico De Novo Discovery of Novel Target-specific Drug-like Bidentate Inhibitors of PTP 1B

Journal: Letters in Drug Design & Discovery
Volume: 21 Issue: 4 Year: 2024 Page: 763-781
Author(s): Sant Kumar Verma

Research Article

Design and Study of In Silico Binding Dynamics of Certain Isoxazole Bearing Leads Against Aβ-42 and BACE-1 Loop in Protein Fibrillation

Journal: Letters in Drug Design & Discovery
Volume: 19 Issue: 3 Year: 2022 Page: 192-213
Author(s): Puja Mishra,Souvik Basak,Arup Mukherjee,Anindya Basu

Research Article

Identification of the NF-κB Inhibition Peptides in Asthma from Pheretimaaspergillum Decoction and Formula Granules using Molecular Dockingand Dynamics Simulations

Journal: Current Pharmaceutical Analysis
Volume: 20 Issue: 3 Year: 2024 Page: 202-211
Author(s):

Drug Design of GPCR Ligands Using Physicogenetics and Chemogenomics - Principles and Case Studies

Journal: Current Topics in Medicinal Chemistry
Volume: 11 Issue: 1 Year: 2011 Page: 1882-1901
Author(s): Thomas M. Frimurer, Thomas Hogberg

Research Article

In silico Analysis of Natural Inhibitors against HPV E6 Protein

Journal: Current Computer-Aided Drug Design
Volume: 20 Issue: 3 Year: 2024 Page: 303-311
Author(s): Arpitha B. Hegde

Therapeutic Approaches to Eradicate Latent HIV-1 in Resting CD4+ T Cells

Journal: Current Topics in Medicinal Chemistry
Volume: 16 Issue: 1 Year: 2016 Page: 1191-1197
Author(s): Nicolas Sluis-Cremer

Research Article

2, 4, 5-Trideoxyhexopyranosides Derivatives of 4’-Demethylepipodophyllotoxin: De novo Synthesis and Anticancer Activity

Journal: Medicinal Chemistry
Volume: 18 Issue: 1 Year: 2022 Page: 130-139
Author(s): Yapeng Lu,Li Zhu,Rui Cai,Yu Li,Yu Zhao

Ligand-Protein Docking: Cancer Research at the Interface between Biology and Chemistry

Journal: Current Medicinal Chemistry
Volume: 10 Issue: 9 Year: 2003 Page: 763-777
Author(s): R. C. Glen, S. C. Allen

Research Article

Structural Insights into the IL12:IL12 Receptor Complex Assembly byMolecular Modeling, Docking, and Molecular Dynamics Simulation

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 25 Issue: 4 Year: 2022 Page: 677-688
Author(s): Sakshi Singh,Geeta Rai

Review Article

Regulation of Na+/K+-ATPase by Estradiol and IGF-1 in Cardio-Metabolic Diseases

Journal: Current Pharmaceutical Design
Volume: 23 Issue: 10 Year: 2017 Page: 1551-1561
Author(s): Milan Obradovic,Julijana Stanimirovic,Anastasija Panic,Nikola Bogdanovic,Emina Sudar-Milovanovic,Desanka Cenic-Milosevic,Esma R. Isenovic

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