12 Packages since 2019
User Packages
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MDLovoFit.jl2Julia wrapper for the MDLovoFit package
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MolSimToolkit.jl9A set of tools for analyzing molecular dynamics simulations
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SolventShellInteractions.jl7Computes the interaction potential between a solute and the solvent molecules having at least one atom within a cutoff distance from the solute.
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MolecularMinimumDistances.jl8Computes the set of minimum distances between to sets of particles, which can be grouped (like in molecules).
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FundamentosDMC.jl9Material para el curso Fundamentos de Mecánica Estadística y Simulaciones: Simulación Computacional Avanzada en Química, Bioquímica y Ciencias de Materiales. CELFI/Universidad de Buenos Aires
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Packmol.jl21The future of Packmol
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CellListMap.jl87Flexible implementation of cell lists to map the calculations of particle-pair dependent functions, such as forces, energies, neighbor lists, etc.
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JuliaNotes.jl157A collection of examples and explanations about Julia
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SPGBox.jl17Spectral Projected Gradient Method for Box-Constrained Minimization
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EasyFit.jl37Easy interface for obtaining fits for 2D data
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ComplexMixtures.jl15Package to perform minimum-distance distribution analyses of complex solute-solvent interactions
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PDBTools.jl11Simple structure and functions to read and write PDB files
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