All Stories

  1. Computational Modeling on Binding Interactions of Cyclodextrin s with the Human Multidrug Resistance P-glycoprotein Toward Efficient Drug-delivery System Applications
  2. Ensemble-Based Modeling of Chemical Compounds with Antimalarial Activity
  3. Computer-aided Drug Discovery Methodologies in the Modeling of Dual Target Ligands as Potential Parkinson’s Disease Therapeutics
  4. In Silico Studies Targeting G-protein Coupled Receptors for Drug Research Against Parkinson’s Disease
  5. Cetuximab and the Head and Neck Squamous Cell Cancer
  6. Looking for New Inhibitors for the Epidermal Growth Factor Receptor
  7. Probing the Hypothesis of SAR Continuity Restoration by the Removal of Activity Cliffs Generators in QSAR
  8. Classification of Natural Estrogen-Like Isoflavonoids and Diphenolics by QSAR Tools
  9. In Silico Assessment of the Acute Toxicity of Chemicals: Recent Advances and New Model for Multitasking Prediction of Toxic Effect
  10. Enabling Virtual Screening of Potent and Safer Antimicrobial Agents Against Noma: mtk-QSBER Model for Simultaneous Prediction of Antibacterial Activities and ADMET Properties
  11. Editorial (Thematic Issue: Nosocomial Infections: An Increasing Challenge to Medicinal Chemistry)