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Article

Computational study of protein specificity: the molecular basis of HIV-1 protease drug resistance.

Proceedings of the National Academy of Sciences of the United States of America - 18 Dec 2001

Wang W, Kollman P A

Abstract excerpt

Drug resistance has sharply limited the effectiveness of HIV-1 protease inhibitors in AIDS therapy. It is critically important to understand the basis of this resistance for designing new drugs. We have evaluated the free energy contribution of each residue in the HIV protease in binding to one of its substrates and to the five FDA-approved protease drugs. Analysis of these free energy profiles and the...

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Methodology Data sources Editorial policy Privacy About Contact Helena Bioinformatics

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Source

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Identifiers

PMID: 11752442
DOI: 10.1073/pnas.251265598
PMCID: PMC64962

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PubMed metadata and Literature Corpus relationships. Corpus snapshot updated 7 Sept 2026. Manifest publication-graph-cohort-2026-09-07.1.

Source receipt: pubmed, retrieved 7 Sept 2026.

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