All Stories

  1. Molybdenum‐Catalyzed Deoxydehydration of Vicinal Diols
  2. Synergy between experimental and theoretical methods in the exploration of homogeneous transition metal catalysis
  3. Nicotinamide Phosphoribosyltransferase Inhibitors, Design, Preparation, and Structure–Activity Relationship
  4. Synthesis of an Orthogonal Topological Analogue of Helicene
  5. Mechanistic investigation of the one-pot formation of amides by oxidative coupling of alcohols with amines in methanol
  6. Cis–Trans Amide Bond Rotamers in β-Peptoids and Peptoids: Evaluation of Stereoelectronic Effects in Backbone and Side Chains
  7. Mechanistic Investigation of Palladium-Catalyzed Allylic C–H Activation
  8. ReaxFF: A Reactive Force Field for the Simulation of Biomolecules and Proteins.
  9. Mechanistic Investigation of the Ruthenium–N‐Heterocyclic‐Carbene‐Catalyzed Amidation of Amines with Alcohols
  10. Gold Nanoparticle‐Catalyzed Formation of Nitrogen‐containing Compounds—From Mechanistic Understanding to Synthetic Exploitation
  11. One-pot synthesis of amides by aerobic oxidative coupling of alcohols or aldehydes with amines using supported gold and base as catalysts
  12. Mechanistic investigation of the iridium-catalysed alkylation of amines with alcohols
  13. Structure-Based Prediction of Subtype Selectivity of Histamine H3 Receptor Selective Antagonists in Clinical Trials
  14. γ‐ and δ‐Lactams through Palladium‐Catalyzed Intramolecular Allylic Alkylation: Enantioselective Synthesis, NMR Investigation, and DFT Rationalization
  15. Palladium Catalyzed Allylic C-H Alkylation: A Mechanistic Perspective
  16. Metal‐Free Dehydration of Glucose to 5‐(Hydroxymethyl)furfural in Ionic Liquids with Boric Acid as a Promoter
  17. Target enzyme mutations are the molecular basis for resistance towards pharmacological inhibition of nicotinamide phosphoribosyltransferase
  18. Toward Efficient Palladium‐Catalyzed Allylic CH Alkylation
  19. Mechanistic Study of the sPLA2-Mediated Hydrolysis of a Thio-ester Pro Anticancer Ether Lipid
  20. Enantioselective γ-Lactam Synthesis via Palladium-Catalyzed Intramolecular Asymmetric Allylic Alkylation
  21. On the Nature of the Intermediates and the Role of Chloride Ions in Pd-Catalyzed Allylic Alkylations: Added Insight from Density Functional Theory
  22. Unusual Selectivity-Determining Factors in the Phosphine-Free Heck Arylation of Allyl Ethers
  23. The Mechanism for the Rhodium-Catalyzed Decarbonylation of Aldehydes: A Combined Experimental and Theoretical Study
  24. Novofumigatonin, a New Orthoester Meroterpenoid from Aspergillus novofumigatus
  25. Mechanistic investigation of the gold-catalyzed aerobic oxidation of aldehydes: added insight from Hammett studies and isotopic labelling experiments
  26. Memory Effects in Palladium‐Catalyzed Allylic Alkylations of 2‐Cyclohexen‐1‐yl Acetate
  27. Mechanistic Investigation of the Gold-catalyzed Aerobic Oxidation of Alcohols
  28. Direct determination of absolute configuration: a vibrational circular dichroism study on dimethyl-substituted phenyloxiranes synthesized by Shi epoxidation
  29. Direct Determination of Absolute Configuration of Methyl-Substituted Phenyloxiranes:  Combined Experimental and Theoretical Approach
  30. Deconvoluting the Memory Effect in Pd‐Catalyzed Allylic Alkylation: Effect of Leaving Group and Added Chloride
  31. Combining Q2MM modeling and kinetic studies for refinement of the osmium-catalyzed asymmetric dihydroxylation (AD) mnemonic
  32. Theoretical Evidence for Low-Ligated Palladium(0):  [Pd−L] as the Active Species in Oxidative Addition Reactions
  33. Nonradical Zinc−Barbier Reaction for Diastereoselective Synthesis of Vicinal Amino Alcohols
  34. Probing Competitive Enantioselective Approach Vectors Operating in the Jacobsen−Katsuki Epoxidation:  A Kinetic Study of Methyl-Substituted Styrenes
  35. Surprisingly Mild “Enolate‐Counterion‐Free” Pd(0)‐Catalyzed Intramolecular Allylic Alkylations.
  36. Surprisingly Mild “Enolate-Counterion-Free” Pd(0)-Catalyzed Intramolecular Allylic Alkylations
  37. Reactivity and Regioselectivity in the Heck Reaction:  Hammett Study of 4-Substituted Styrenes
  38. Updating the asymmetric osmium‐catalyzed dihydroxylation (AD) mnemonic: Q2MM modeling and new kinetic measurements