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The Free Energy and Advanced Sampling Simulation Toolkit (FEASST) is a free, open-source, modular program to conduct molecular and particle-based simulations with flat-histogram Monte Carlo and...
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teqp is a library written in C++ that allows for calculation of numerical derivatives of thermodynamic equations of state with respect to the independent variables with numerical differentiation...
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CyRSoXS: A GPU-accelerated virtual instrument for Polarized Resonant Soft X-ray Scattering (P-RSoXS)
Polarized Resonant Soft X-ray scattering (P-RSoXS) has emerged as a powerful synchrotron-based tool to measure structure in complex, chemically heterogeneous systems. P-RSoXS combines principles...
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This record contains C++ code and a Docker release for performing curve skeletonization of objects, which have a voxel representation. Curve skeletonization is used to convert a...
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The library multicomplex is an implementation of multicomplex algebra in C++ to allow for higher-order derivatives of numerical functions. Many (though not all) mathematical functions are...
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An archival version of the potter C++ library for integrating potentials to obtain virial coefficients.
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