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[HTML][HTML] Computer-aided drug design and drug discovery: a prospective analysis
In the dynamic landscape of drug discovery, Computer-Aided Drug Design (CADD) emerges
as a transformative force, bridging the realms of biology and technology. This paper …
as a transformative force, bridging the realms of biology and technology. This paper …
Advances in applying computer-aided drug design for neurodegenerative diseases
Neurodegenerative diseases (NDs) including Alzheimer's disease, Parkinson's disease,
amyotrophic lateral sclerosis, and Huntington's disease are incurable and affect millions of …
amyotrophic lateral sclerosis, and Huntington's disease are incurable and affect millions of …
In silico Methods for Design of Kinase Inhibitors as Anticancer Drugs
Rational drug design implies usage of molecular modeling techniques such as
pharmacophore modeling, molecular dynamics, virtual screening, and molecular docking to …
pharmacophore modeling, molecular dynamics, virtual screening, and molecular docking to …
Novel small molecule therapeutic agents for Alzheimer disease: Focusing on BACE1 and multi-target directed ligands
Alzheimer's Disease (AD) is a progressive neurodegenerative disorder that effects 50 million
people worldwide. In this review, AD pathology and the development of novel therapeutic …
people worldwide. In this review, AD pathology and the development of novel therapeutic …
Exploring the structure–activity relationship and interaction mechanism of flavonoids and α-glucosidase based on experimental analysis and molecular docking …
H Tang, L Huang, C Sun, D Zhao - Food & Function, 2020 - pubs.rsc.org
α-Glucosidase (AG) has always been an indispensable drug target for the treatment of type
2 diabetes. Herein, an integrated method consisting of enzyme kinetics, multi-spectroscopy …
2 diabetes. Herein, an integrated method consisting of enzyme kinetics, multi-spectroscopy …
The promises and challenges of toxico-epigenomics: environmental chemicals and their impacts on the epigenome
Background: It has been estimated that a substantial portion of chronic and
noncommunicable diseases can be caused or exacerbated by exposure to environmental …
noncommunicable diseases can be caused or exacerbated by exposure to environmental …
[HTML][HTML] Transforming drug design: Innovations in computer-aided discovery for biosimilar agents
In pharmaceutical research and development, pursuing novel therapeutics and optimizing
existing drugs have been revolutionized by the fusion of cutting-edge technologies and …
existing drugs have been revolutionized by the fusion of cutting-edge technologies and …
In silico approaches in carcinogenicity hazard assessment: current status and future needs
Historically, identifying carcinogens has relied primarily on tumor studies in rodents, which
require enormous resources in both money and time. In silico models have been developed …
require enormous resources in both money and time. In silico models have been developed …
Novel triazolophthalazine-hydrazone hybrids as potential PCAF inhibitors: Design, synthesis, in vitro anticancer evaluation, apoptosis, and molecular docking studies
Three novel series of triazolophthalazine derivatives bearing hydrazone moiety were
designed, synthesized, and evaluated for their anticancer activity against four human cancer …
designed, synthesized, and evaluated for their anticancer activity against four human cancer …
A patent review of BRD4 inhibitors (2013-2019)
Introduction: The bromodomain-containing protein 4 (BRD4), a member of the bromodomain
and extra-terminal (BET) family, functions as an 'epigenetic reader'that binds to acetylated …
and extra-terminal (BET) family, functions as an 'epigenetic reader'that binds to acetylated …