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RSS Feeds[ASAP] Development of the FMO/RI-MP2 Fully Analytic Gradient Using a Hybrid-Distributed/Shared Memory Programming Model (Journal of Chemical Theory and Computation)

 
 

28 january 2020 00:00:12

 
[ASAP] Development of the FMO/RI-MP2 Fully Analytic Gradient Using a Hybrid-Distributed/Shared Memory Programming Model (Journal of Chemical Theory and Computation)
 


Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01082


 
184 viewsCategory: Chemistry
 
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[ASAP] Revisiting OPLS-AA Force Field for the Simulation of Anionic Surfactants in Concentrated Electrolyte Solutions (Journal of Chemical Theory and Computation)
 
 
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