Aug 242015
 

FlexAID 2.48 / NRGsuite 2.48f

:: DESCRIPTION

NRGsuite is a PyMOL plugin to perform docking simulations in real time using FlexAID.

::DEVELOPER

Najmanovich Research Group

:: SCREENSHOTS

NRGsuite

:: REQUIREMENTS

  • Windows/Linux/MacOsX
  • Python
  • PyMOL

:: DOWNLOAD

 NRGsuite , FlexAID.

:: MORE INFORMATION

Citation

NRGsuite: a PyMOL plugin to perform docking simulations in real time using FlexAID.
Gaudreault F, Morency LP, Najmanovich RJ.
Bioinformatics. 2015 Aug 6. pii: btv458.

FlexAID: Revisiting Docking on Non-Native-Complex Structures.
Gaudreault F, Najmanovich RJ.
J Chem Inf Model. 2015 Jul 27;55(7):1323-36. doi: 10.1021/acs.jcim.5b00078.

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