How design statistics concepts can improve experimentation in medicinal chemistry

The active site of HIV-1 protease.

Medicinal research reviews·2001

A comparison of backpropagation and generalized-regression genetic-neural network models.

Drug design and discovery·1999

Molecular simulation of the primary and secondary structures of the Abeta(1-42)-peptide of Alzheimer's disease.

Medicinal research reviews·1998

Evidence of a butterfly-like configuration of structurally diverse allosteric inhibitors of the HIV-1 reverse transcriptase.

Drug design and discovery·1996

Molecular simulation of the folding patterns of the omega-loop (Tyr181 to Tyr188) of HIV-1 reverse transcriptase.

Drug design and discovery·1996

A hydrophilic omega-loop (Tyr181 to Tyr188) in the nonsubstrate binding area of HIV-1 reverse transcriptase.

Drug design and discovery·1996

Artificial Intelligence-Driven Natural Product Drug Discovery: From Computational Genome Mining to Clinical Translation.

Medicinal research reviews·2026

Navigating the Complexity: A Comprehensive Review of GSK-3 Inhibition in Regenerative Medicine.

Medicinal research reviews·2026

Advancing Therapies for Mycobacterial Diseases: From Small Molecules to Host-Directed Strategies.

Medicinal research reviews·2026

Hepatotoxicity in the Era of Precision Medicine: Toxicological Mechanisms and Management of Immune and Cell Therapy-Induced Liver Injury.

Medicinal research reviews·2026

Recent Advances in Cryogel Applications for Musculoskeleatal Regeneration.

Medicinal research reviews·2026

Senotherapeutics for Knee Osteoarthritis.

Medicinal research reviews·2026

Small-molecule cocktail 2SM promotes heart regeneration via inducing embryonic-like cardiomyocyte state.

Cell regeneration (London, England)·2026

Integrated in silico screening and biophysical evaluation of three plant flavonoids interacting with Newcastle disease virus proteins.

Virus genes·2026

Macrocycle-mediated modulation and repurposing of antibacterial and non-antibacterial drugs.

Organic & biomolecular chemistry·2026

Structure-based screening and identification of a novel Aurora-A-targeting peptide with antiproliferative activity against prostate cancer cells.

Journal of enzyme inhibition and medicinal chemistry·2026

Construction of CF2 moieties in FDA-approved drugs (2016-2025): industrial routes, mechanisms, and scale-up considerations.

Beilstein journal of organic chemistry·2026

Cannabidiol as a Promising Anti-Inflammatory Agent Targeting TYK2: Molecular Docking and Dynamic Simulation Approaches for Therapeutic Applications in Multiple Sclerosis.

Current drug discovery technologies·2026

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How design statistics concepts can improve experimentation in medicinal chemistry

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The active site of HIV-1 protease.

A comparison of backpropagation and generalized-regression genetic-neural network models.

Molecular simulation of the primary and secondary structures of the Abeta(1-42)-peptide of Alzheimer's disease.

Evidence of a butterfly-like configuration of structurally diverse allosteric inhibitors of the HIV-1 reverse transcriptase.

Molecular simulation of the folding patterns of the omega-loop (Tyr181 to Tyr188) of HIV-1 reverse transcriptase.

A hydrophilic omega-loop (Tyr181 to Tyr188) in the nonsubstrate binding area of HIV-1 reverse transcriptase.

Artificial Intelligence-Driven Natural Product Drug Discovery: From Computational Genome Mining to Clinical Translation.

Navigating the Complexity: A Comprehensive Review of GSK-3 Inhibition in Regenerative Medicine.

Advancing Therapies for Mycobacterial Diseases: From Small Molecules to Host-Directed Strategies.

Hepatotoxicity in the Era of Precision Medicine: Toxicological Mechanisms and Management of Immune and Cell Therapy-Induced Liver Injury.

Recent Advances in Cryogel Applications for Musculoskeleatal Regeneration.

Senotherapeutics for Knee Osteoarthritis.

Small-molecule cocktail 2SM promotes heart regeneration via inducing embryonic-like cardiomyocyte state.

Integrated in silico screening and biophysical evaluation of three plant flavonoids interacting with Newcastle disease virus proteins.

Macrocycle-mediated modulation and repurposing of antibacterial and non-antibacterial drugs.

Structure-based screening and identification of a novel Aurora-A-targeting peptide with antiproliferative activity against prostate cancer cells.

Construction of CF2 moieties in FDA-approved drugs (2016-2025): industrial routes, mechanisms, and scale-up considerations.

Cannabidiol as a Promising Anti-Inflammatory Agent Targeting TYK2: Molecular Docking and Dynamic Simulation Approaches for Therapeutic Applications in Multiple Sclerosis.

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How design statistics concepts can improve experimentation in medicinal chemistry

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