24 results on '"Whitehead, Lewis"'
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2. Computer simulation of biological membranes and membrane bound proteins
3. Small Molecule-facilitated Degradation of ANO1 Protein
4. Atomic-scale characterization of conformational changes in the preQ 1 riboswitch aptamer upon ligand binding
5. Human HDAC isoform selectivity achieved via exploitation of the acetate release channel with structurally unique small molecule inhibitors
6. Avoidance of the Ames test liability for aryl–amines via computation
7. Seed, Foster, Believe, Dream and Act. Capacity Building in Kenya by Novartis Global Discovery Chemistry, Seeding Labs, the International Activities Committee, and the Computers in Chemistry Division of the ACS between 2010−2014
8. An investigation into pharmaceutically relevant mutagenicity data and the influence on Ames predictive potential
9. The Chemical Tuning of a Weak Zinc Binding Motif for Histone Deacetylase Using Electronic Effects
10. Application of Non-Parametric Regression to Quantitative Structure–Activity Relationships
11. Antibacterial and Solubility Optimization of Thiomuracin A
12. Development of isoform selective PI3-kinase inhibitors as pharmacological tools for elucidating the PI3K pathway
13. FOCUS — Development of a Global Communication and Modeling Platform for Applied and Computational Medicinal Chemists
14. The design, synthesis and structure–activity relationships of novel isoindoline-based histone deacetylase inhibitors
15. Automated Ligand- and Structure-Based Protocol for in Silico Prediction of Human Serum Albumin Binding
16. Identification of Elongation Factor G as the Conserved Cellular Target of Argyrin B
17. Discovery of LFF571: An Investigational Agent for Clostridium difficile Infection
18. Antibacterial Optimization of 4-Aminothiazolyl Analogues of the Natural Product GE2270 A: Identification of the Cycloalkylcarboxylic Acids
19. Atomic-scale characterization of conformational changes in the preQ1 riboswitch aptamer upon ligand binding
20. Optimization of the in Vitro Cardiac Safety of Hydroxamate-Based Histone Deacetylase Inhibitors
21. Conformational Refinement of Hydroxamate-Based Histone Deacetylase Inhibitors and Exploration of 3-Piperidin-3-ylindole Analogues of Dacinostat (LAQ824)
22. Molecular dynamics simulation of the hydrocarbon region of a biomembrane using a reduced representation model
23. γ-Dissociations of 3-alkylbicyclo[1.1.1]pent-1-yl radicals into [1.1.1]propellane and alkyl radicals: verification of a theoretical prediction
24. γ-Dissociations of 3-alkylbicyclo[1.1.1]pent-1-yl radicals into [1.1.1]propellane and alkyl radicals: verification of a theoretical prediction
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