/tools/ComplexMixtures.jl
ComplexMixtures.jl
m3g/ComplexMixtures.jl
summary
ComplexMixtures.jl is a Julia package designed to study the interactions between solutes and solvents of complex molecular shapes. It utilizes minimum-distance distribution functions to analyze these interactions, providing insights into molecular behavior in solutions.
description
Package to perform minimum-distance distribution analyses of complex solute-solvent interactions
topics
amberchemistrydistribution-functiongromacslammpsmolecular-dynamicsmolecular-dynamics-simulationmolecular-modelingmolecular-simulationnamd
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