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Studer Gabriel authored
!!EXPERIMENTAL FEATURE!! The plugin gets loaded by OpenMM as a dynamic library and is capable of updating forces acting on particles in a running OpenMM simulation/minimization. The DensityForce takes a ost map as an input and generates forces based on Topf et al., 2008 Protein Structure Fitting and Refinement Guided by CryoEM Density
Studer Gabriel authored!!EXPERIMENTAL FEATURE!! The plugin gets loaded by OpenMM as a dynamic library and is capable of updating forces acting on particles in a running OpenMM simulation/minimization. The DensityForce takes a ost map as an input and generates forces based on Topf et al., 2008 Protein Structure Fitting and Refinement Guided by CryoEM Density
simulation.cc 32.33 KiB