Virtual Screening Algorithms in Drug Discovery: A Review Focused on Machine and Deep Learning Methods

Tiago Alves de Oliveira, Michel Pires da Silva, Eduardo Habib Bechelane Maia, Alisson Marques da Silva, Alex Gutterres Taranto

Drugs and Drug Candidates 2023 article cited by 136

importance 8/10 ai assisted Computational Drug Discovery Methods pharmaceutical R&D stage: research

Drug discovery and repositioning demand high resource investment and are time-consuming for the pharmaceutical industry.

High costs and long timelines burden pharmaceutical development of new therapies.

Reviews machine and deep learning algorithms used in virtual screening to select candidate molecules toward therapeutic targets in silico.

not stated in source

Review describes ML/DL contributions to drug design; no measured impact stated.

Venue Drugs and Drug Candidates
Published 2023
Work type article
Authors Tiago Alves de Oliveira, Michel Pires da Silva, Eduardo Habib Bechelane Maia, Alisson Marques da Silva, Alex Gutterres Taranto
Citations 136 (OpenAlex, at import time)
References 157
Model or method not stated in source
Organization not stated in source
Primary source https://doi.org/10.3390/ddc2020017
Open access gold
Keywords virtual screening, drug discovery, machine learning, deep learning, computer-aided drug design
8 / 10

major — millions of lives, an industry or a field

Drug discovery/repositioning costs and timelines burden an entire industry and delay new therapies for millions; abstract gives no quantified scale.

Basis: inferred. Judged from the source text, which gives no explicit scale. Stated scale: not stated in source. Method and limits.

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