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RSS Feeds[ASAP] Massive-Scale Binding Free Energy Simulations of HIV Integrase Complexes Using Asynchronous Replica Exchange Framework Implemented on the IBM WCG Distributed Network (Journal of Chemical Information and Modeling)

 
 

23 february 2019 00:03:17

 
[ASAP] Massive-Scale Binding Free Energy Simulations of HIV Integrase Complexes Using Asynchronous Replica Exchange Framework Implemented on the IBM WCG Distributed Network (Journal of Chemical Information and Modeling)
 


Journal of Chemical Information and ModelingDOI: 10.1021/acs.jcim.8b00817


 
47 viewsCategory: Chemistry
 
[ASAP] QUBEKit: Automating the Derivation of Force Field Parameters from Quantum Mechanics (Journal of Chemical Information and Modeling)
[ASAP] Oligophosphine-thiocyanate Copper(I) and Silver(I) Complexes and Their Borane Derivatives Showing Delayed Fluorescence (Inorganic Chemistry)
 
 
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