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Drug Development

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Recent progress in machine learning approaches for predicting carcinogenicity in drug development.

Expert opinion on drug metabolism & toxicology
INTRODUCTION: This review explores the transformative impact of machine learning (ML) on carcinogenicity prediction within drug development. It discusses the historical context and recent advancements, emphasizing the significance of ML methodologies...

Best practices for machine learning in antibody discovery and development.

Drug discovery today
In the past 40 years, therapeutic antibody discovery and development have advanced considerably, with machine learning (ML) offering a promising way to speed up the process by reducing costs and the number of experiments required. Recent progress in ...

Another string to your bow: machine learning prediction of the pharmacokinetic properties of small molecules.

Expert opinion on drug discovery
INTRODUCTION: Prediction of pharmacokinetic (PK) properties is crucial for drug discovery and development. Machine-learning (ML) models, which use statistical pattern recognition to learn correlations between input features (such as chemical structur...

An extensive review on lung cancer therapeutics using machine learning techniques: state-of-the-art and perspectives.

Journal of drug targeting
There are over 100 types of human cancer, accounting for millions of deaths every year. Lung cancer alone claims over 1.8 million lives per year and is expected to surpass 3.2 million by 2050, which underscores the urgent need for rapid drug developm...

The role and future prospects of artificial intelligence algorithms in peptide drug development.

Biomedicine & pharmacotherapy = Biomedecine & pharmacotherapie
Peptide medications have been more well-known in recent years due to their many benefits, including low side effects, high biological activity, specificity, effectiveness, and so on. Over 100 peptide medications have been introduced to the market to ...

A comprehensive assessment of machine learning algorithms for enhanced characterization and prediction in orodispersible film development.

International journal of pharmaceutics
Orodispersible films (ODFs) have emerged as innovative pharmaceutical dosage forms, offering patient-specific treatment through adjustable dosing and the combination of diverse active ingredients. This expanding field generates vast datasets, requiri...

Recent advances in the development of DprE1 inhibitors using AI/CADD approaches.

Drug discovery today
Tuberculosis (TB) is a global lethal disease caused by Mycobacterium tuberculosis (Mtb). The flavoenzyme decaprenylphosphoryl-β-d-ribose 2'-oxidase (DprE1) plays a crucial part in the biosynthesis of lipoarabinomannan and arabinogalactan for the cell...