openmm
Here are 9 public repositories matching this topic...
An OpenMM plugin implementing the AGBNP implicit solvent model
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Oct 26, 2019 - C++
OpenMM plugin to implement single-decoupling method in alchemical free energy calculations
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Apr 22, 2021 - C++
Plugin for OpenMM providing simulation data wrappers as DLPack data structures
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Oct 9, 2024 - C++
Restrained ensemble molecular dynamics method implementation for small angle scattering data.
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Jan 15, 2021 - C++
A plugin to add Gaussian surface area model to OpenMM
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Nov 29, 2018 - C++
Conda environment for C++ development with OpenMM
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Jan 12, 2018 - C++
Platform-agnostic OpenMM Forces
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Feb 2, 2024 - C++
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