1. Modeling of enzyme–substrate complexes for the metalloproteases MMP-3, ADAM-9 and ADAM-10

   • Sergio Manzetti
   • Daniel R. McCulloch
   • David van der Spoel

   OriginalPaper Pages: 551 - 565

2. Inhibition and substrate recognition – a computational approach applied to HIV protease

   • H.M. Vinkers
   • M.R. de Jonge
   • P.A.J. Janssen

   OriginalPaper Pages: 567 - 581

3. Computational studies of new potential antimalarial compounds – Stereoelectronic complementarity with the receptor

   • César Portela
   • Carlos M.M. Afonso
   • Maria João Ramos

   OriginalPaper Pages: 583 - 595

4. A novel scoring function for molecular docking

   • A.E. Muryshev
   • D.N. Tarasov
   • S.M. Nikitin

   OriginalPaper Pages: 597 - 605

5. New atom-type-based AI topological indices: Application to QSPR studies of aldehydes and ketones

   • Biye Ren

   OriginalPaper Pages: 607 - 619