All Stories

  1. Chemometrics as a Powerful and Complementary Tool for Mass Spectrometry Applications in Life Sciences
  2. Pharmacophore Modeling, Synthesis, Scaffold Hopping and Biological β- Hematin Inhibition Interaction Studies for Anti-malaria Compounds
  3. Anthracene modified graphene oxide-silica as an optical sensor for selective detection of Cu2+ and I− ions
  4. Three dimensional quantitative structure activity relationship and pharmacophore modeling of tacrine derivatives as acetylcholinesterase inhibitors in Alzheimer's treatment
  5. Probing the origin of dihydrofolate reductase inhibition via proteochemometric modeling
  6. The Effect of Single and Double Acetylation of Lysine Residues on Structural and Dynamical Features of Human Splicing Factor TDP-43 - A Statistical Ensemble Analysis
  7. High-Throughput Docking and Molecular Dynamics Simulations towards the Identification of Novel Peptidomimetic Inhibitors against CDC7
  8. In Silico Studies in Drug Research Against Neurodegenerative Diseases
  9. Docking of Natural Products against Neurodegenerative Diseases: General Concepts
  10. Dual-acting of Hybrid Compounds - A New Dawn in the Discovery of Multi-target Drugs: Lead Generation Approaches
  11. Computer-aided drug design to explore cyclodextrin therapeutics and biomedical applications
  12. Application of Multivariate Linear and Nonlinear Calibration and Classification Methods in Drug Design
  13. An improved ensemble learning machine for biological activity prediction of tyrosine kinase inhibitors
  14. Discovery of New Potential Antimalarial Compounds Using Virtual Screening of ZINC Database
  15. Multivariate curve resolution alternating least squares in the quantitative determination of sulfur using overlapped S(Kα)-Mo(Lα) emission peaks by wavelength dispersive X-ray fluorescence spectrometry
  16. Using chemometric methods for overlap correction of sodium-zinc spectral lines generated by wavelength dispersive X-ray fluorescence in mineral samples