recent publications

• academic article

  • Cosconati, S., Marinelli, L., Di Leva, F. S., La Pietra, V., De Simone, A., Mancini, F., Andrisano, V., Novellino, E., Goodsell, D. S., Olson, A. J. Protein flexibility in virtual screening: the BACE-1 case study Journal of Chemical Information and Modeling  2012 52:2697-2704  DOI:10.1021/ci300390h  PMID:23005250  PMCID:PMC3523752
  • Cosconati, S., Marinelli, L., Trotta, R., Virno, A., Mayol, L., Novellino, E., Olson, A. J., Randazzo, A. Tandem application of virtual screening and NMR experiments in the discovery of brand new DNA quadruplex groove binders Journal of the American Chemical Society  2009 131:16336-16337  DOI:10.1021/ja9063662  PMID:19856964
  • Cosconati, S., Marinelli, L., La Motta, C., Sartini, S., Da Settimo, F., Olson, A. J., Novellino, E. Pursuing aldose reductase inhibitors through in situ cross-docking and similarity-based virtual screening Journal of Medicinal Chemistry  2009 52:5578-5581  DOI:10.1021/jm901045w  PMID:19719141
  • Cosconati, S., Hong, J. A., Novellino, E., Carroll, K. S., Goodsell, D. S., Olson, A. J. Structure-based virtual screening and biological evaluation of Mycobacterium tuberculosis adenosine 5'-phosphosulfate reductase inhibitors Journal of Medicinal Chemistry  2008 51:6627-6630  DOI:10.1021/jm800571m  PMID:18855373  PMCID:PMC2639213