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

Unraveling the Intricacies of G-Protein-Coupled Receptor Signaling in Cardiovascular Diseases: Novel Perspectives From Regulation to Therapeutic Targeting.

Medicinal research reviews·2026

Boronic Acid Inhibitors of β-Lactamases: A Promising Strategy Against Antimicrobial Resistance.

Medicinal research reviews·2026

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

Artificial intelligence-guided discovery of marine scalaranes as selective COX-2 inhibitors through machine learning and molecular modelling.

Organic & biomolecular chemistry·2026

Synthesis and preclinical validation of 5HT1A receptor-targeted carbon dots functionalized with Gd3+ and 99mTc as a multi-modal SPECT and MRI probe for molecular imaging.

Nanoscale·2026

Fluorescent NHC Gold(I) Complexes as Tools for Target Identification and Metallomic Studies in Cancer Cells.

Inorganic chemistry·2026

Computational and Experimental Approaches for HPMCAS-Based Solid Dispersions of Abiraterone Acetate: Formulation, Characterization, and Biopharmaceutical Enhancement Evaluation.

Drug development and industrial pharmacy·2026

Vertical Multi-Target Design of Potential Staphylococcus aureus Respiratory Inhibitors: A Systematic in Silico Fragment-Based Approach.

Omics : a journal of integrative biology·2026

M2-PRNet: Multi-Scale and Multi-Modal Learning for Protein-RNA Binding Affinity Prediction.

Bioinformatics (Oxford, England)·2026

Related Experiment Videos

How design statistics concepts can improve experimentation in medicinal chemistry

Related Concept Videos

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.

Unraveling the Intricacies of G-Protein-Coupled Receptor Signaling in Cardiovascular Diseases: Novel Perspectives From Regulation to Therapeutic Targeting.

Boronic Acid Inhibitors of β-Lactamases: A Promising Strategy Against Antimicrobial Resistance.

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.

Artificial intelligence-guided discovery of marine scalaranes as selective COX-2 inhibitors through machine learning and molecular modelling.

Synthesis and preclinical validation of 5HT1A receptor-targeted carbon dots functionalized with Gd3+ and 99mTc as a multi-modal SPECT and MRI probe for molecular imaging.

Fluorescent NHC Gold(I) Complexes as Tools for Target Identification and Metallomic Studies in Cancer Cells.

Computational and Experimental Approaches for HPMCAS-Based Solid Dispersions of Abiraterone Acetate: Formulation, Characterization, and Biopharmaceutical Enhancement Evaluation.

Vertical Multi-Target Design of Potential Staphylococcus aureus Respiratory Inhibitors: A Systematic in Silico Fragment-Based Approach.

M2-PRNet: Multi-Scale and Multi-Modal Learning for Protein-RNA Binding Affinity Prediction.

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How design statistics concepts can improve experimentation in medicinal chemistry

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