THE ALGORITHMIC APOTHECARY: ACCELERATING DRUG DISCOVERY FROM OMICS TO OUTCOMES

Artificial Intelligence (AI), encompassing Machine Learning (ML) and Deep Learning (DL), is revolutionizing traditional drug discovery, a process traditionally characterized by long timelines (10 to 17 years) and high costs (up to 2.8 billion). AI enhances efficiency, accuracy, and success rates across the pharmaceutical pipeline, accelerating target identification, de novo drug design, virtual screening (VS), and clinical trial optimization. Key methodologies include Neural Networks (NNs), Graph Neural Networks (GNNs), and Natural Language Processing (NLP). Despite significant promise, widespread adoption is hindered by challenges relating to data quality, model interpretability ("black box" issues), and evolving ethical/regulatory frameworks. AI integration aims to usher in an era of personalized, cost-effective, and safer therapeutics.

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Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2026-02-01
DOI
https://doi.org/10.5281/zenodo.18428342
Primary Topic
Machine Learning in Healthcare
Type
article
Field-Weighted Citation Impact
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article

THE ALGORITHMIC APOTHECARY: ACCELERATING DRUG DISCOVERY FROM OMICS TO OUTCOMES

Najiya Mulla*
Zenodo (CERN European Organization for Nuclear Research)
Machine Learning in Healthcare
article

THE ALGORITHMIC APOTHECARY: ACCELERATING DRUG DISCOVERY FROM OMICS TO OUTCOMES

Najiya Mulla*
article en

Abstract

Artificial Intelligence (AI), encompassing Machine Learning (ML) and Deep Learning (DL), is revolutionizing traditional drug discovery, a process traditionally characterized by long timelines (10 to 17 years) and high costs (up to 2.8 billion). AI enhances efficiency, accuracy, and success rates across the pharmaceutical pipeline, accelerating target identification, de novo drug design, virtual screening (VS), and clinical trial optimization. Key methodologies include Neural Networks (NNs), Graph Neural Networks (GNNs), and Natural Language Processing (NLP). Despite significant promise, widespread adoption is hindered by challenges relating to data quality, model interpretability ("black box" issues), and evolving ethical/regulatory frameworks. AI integration aims to usher in an era of personalized, cost-effective, and safer therapeutics.

Zenodo (CERN European Organization for Nuclear Research)
Openalex Percentile: Top 73%
Machine Learning in Healthcare
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