Drug-perturbed Essential Dynamics / Molecular Dynamics for Virtual Screening

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PCT Application Nº PCT/EP2012/069636

Applicant:

  • Universitat de Barcelona
  • Barcelona Supercomputing Center - Centro Nacional de Supercomputación
  • Fundació Privada Institut de Recerca Biomèdica
  • The University of Nottingham

Title:

  • Method of Exploring the Flexibility of Macromolecular Targets and its use in Rational Drug Design
http://patentscope.wipo.int/search/en/detail.jsf?docId=WO2013050481&recNum=159&docAn=EP2012069636&queryString=%28Kinase%29%20&maxRec=79050