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Molecular dynamics simulations

eagle-i ID

http://xula.eagle-i.net/i/00000134-fd28-7aaf-77e4-a45080000000

Resource Type

  1. Material analysis service

Properties

  1. Resource Description
    Molecular dynamics simulations have become one of the essential tools for the investigation of biological macromolecules and also for the process of computer aided drug design. It provides time dependent behavior of a molecular system and in turn offers molecular level insight into structure and function of biological molecules. This technique is routinely used for the study of complex dynamic process that occurs in biological systems such as conformational changes, protein folding, molecular recognition and protein-drug interactions, and provide the means to carry out drug design.
  2. Contact
    Mottamal, Madhu, Ph.D.
  3. Related Resource
    NAMD Molecular Dynamics Software
  4. Related Resource
    CHARMM
  5. Related Resource
    AMBER
  6. Service Provided by
    RCMI Molecular Structure and Modeling Core
  7. Website(s)
    http://ambermd.org/
  8. Website(s)
    http://www.charmm.org/
  9. Website(s)
    http://www.ks.uiuc.edu/Research/namd/
 
RDFRDF
 
Provenance Metadata About This Resource Record
  1. workflow state
    Published
  2. contributor
    sgarner
  3. created
    2012-01-20T16:15:23.415-06:00
  4. creator
    tjohnson
  5. modified
    2012-04-20T16:33:10.903-05:00

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