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  • Akash Khandelwal, Viera Lukacova, Dogan Comez, Daniel M. Kroll, Soumyendu Raha, Stefan Balaz
  • Chemistry, Medicine
  • Journal of medicinal chemistry
  • 2005 (First Publication: 1 August 2005)
  • To alleviate the problems in the receptor-based design of metalloprotein ligands due to inadequacies in the force-field description of coordination bonds, a four-tier approach was devised.Expand
  • Viera Lukacova, Yufen Zhang, Daniel M. Kroll, Soumyendu Raha, Dogan Comez, Stefan Balaz
  • Chemistry, Medicine
  • Journal of medicinal chemistry
  • 2005 (First Publication: 1 April 2005)
  • MMPs and TACE (ADAM-17) assume independent, parallel, or opposite pathological roles in cancer, arthritis, and several other diseases. For therapeutic purposes, selective inhibition of individualExpand
  • Akash Khandelwal, Viera Lukacova, Daniel M. Kroll, Soumyendu Raha, Dogan Comez, Stefan Balaz
  • Chemistry, Medicine
  • The journal of physical chemistry. A
  • 2005 (First Publication: 1 July 2005)
  • The linear response (LR) approximation and similar approaches belong to practical methods for estimation of ligand-receptor binding affinities. The approaches correlate experimental bindingExpand