Search Results for "open-shell" - Page 10
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Showing 2380 open source projects for "open-shell"
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NCDatasets.jl
Load and create NetCDF files in Julia
NCDatasets allows one to read and create netCDF files. NetCDF data set and attribute list behave like Julia dictionaries and variables like Julia arrays. This package implements the CommonDataModel.jl interface, which means that the datasets can be accessed in the same way as GRIB files opened with GRIBDatasets.jl. -
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SimpleTraits.jl
Simple Traits for Julia
This package provides a macro-based implementation of traits, using Tim Holy's trait trick. The main idea behind traits is to group types outside the type-hierarchy and to make dispatch work with that grouping. The difference to Union-types is that types can be added to a trait after the creation of the trait, whereas Union types are fixed after creation. The cool thing about Tim's trick is that there is no performance impact compared to using ordinary dispatch. For a bit of background and a... -
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NeuralOperators.jl
DeepONets, Neural Operators, Physics-Informed Neural Ops in Julia
Neural operator is a novel deep learning architecture. It learns an operator, which is a mapping between infinite-dimensional function spaces. It can be used to resolve partial differential equations (PDE). Instead of solving by finite element method, a PDE problem can be resolved by training a neural network to learn an operator mapping from infinite-dimensional space (u, t) to infinite-dimensional space f(u, t). Neural operator learns a continuous function between two continuous function... -
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PowerSimulations.jl
Julia for optimization simulation and modeling of PowerSystems
PowerSimulations.jl is a Julia package for power system modeling and simulation of Power Systems operations. Provide a flexible modeling framework that can accommodate problems of different complexity and at different time scales. Streamline the construction of large-scale optimization problems to avoid repetition of work when adding/modifying model details. Exploit Julia's capabilities to improve computational performance of large-scale power system quasi-static simulations. The flexible... -
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ReverseDiff
Reverse Mode Automatic Differentiation for Julia
ReverseDiff is a fast and compile-able tape-based reverse mode automatic differentiation (AD) that implements methods to take gradients, Jacobians, Hessians, and higher-order derivatives of native Julia functions (or any callable object, really). While performance can vary depending on the functions you evaluate, the algorithms implemented by ReverseDiff generally outperform non-AD algorithms in both speed and accuracy. -
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Interpolations.jl
Fast, continuous interpolation of discrete datasets in Julia
This package implements a variety of interpolation schemes for the Julia language. It has the goals of ease of use, broad algorithmic support, and exceptional performance. Currently, this package supports B-splines and irregular grids. The API has been designed with the intent to support more options. Initial support for Lanczos interpolation was recently added. Pull requests are more than welcome! It should be noted that the API may continue to evolve over time. -
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patat
Terminal-based presentations using Pandoc
patat (Presentations Atop The ANSI Terminal) is a small tool that allows you to show presentations using only an ANSI terminal. It does not require ncurses. Leverages the great Pandoc library to support many input formats including Literate Haskell. Supports smart slide splitting. Slides can be split up into multiple fragments. There is a live reload mode. Theming support including 24-bit RGB. Auto advancing with configurable delay. Optionally re-wrapping text to terminal width with proper... -
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nvim-hlslens
Hlsearch Lens for Neovim
nvim-hlslens helps you better glance at matched information, and seamlessly jump between matched instances. -
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TableView.jl
A Tables.jl compatible table viewer based on ag-grid
TableView.jl is an ag-grid-based table viewer built on WebIO.jl. It can display arbitrarily large tables by lazy-loading additional data when scrolling (this is the default for datasets with more than 10k rows). -
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EzXML.jl
XML/HTML handling tools for primates
EzXML.jl is a package to handle XML/HTML documents for primates. This package depends on libxml2, which will be automatically installed as an artifact via XML2_jll.jl if you use Julia 1.3 or later. Currently, Windows, Linux, macOS, and FreeBSD are now supported. -
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GeophysicalFlows.jl
Geophysical fluid dynamics pseudospectral solvers with Julia
GeophysicalFlows.jl is a collection of modules that leverage the FourierFlows.jl framework to provide solvers for problems in Geophysical Fluid Dynamics, on periodic domains using Fourier-based pseudospectral methods. -
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JILL.py
A cross-platform installer for the Julia programming language
The enhanced Python fork of JILL, Julia Installer for Linux (and every other platform), Light. -
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KernelAbstractions.jl
Heterogeneous programming in Julia
KernelAbstractions (KA) is a package that enables you to write GPU-like kernels targetting different execution backends. KA is intended to be a minimal and performant library that explores ways to write heterogeneous code. -
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PlotlyJS
Julia library for plotting with plotly.js
Julia interface to plotly.js visualization library. This package constructs plotly graphics using all local resources. To interact or save graphics to the Plotly cloud, use the Plotly package. -
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Distances.jl
A Julia package for evaluating distances (metrics) between vectors
A Julia package for evaluating distances (metrics) between vectors. This package also provides optimized functions to compute column-wise and pairwise distances, which are often substantially faster than a straightforward loop implementation. -
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PySR
High-Performance Symbolic Regression in Python and Julia
PySR is an open-source tool for Symbolic Regression: a machine learning task where the goal is to find an interpretable symbolic expression that optimizes some objective. Over a period of several years, PySR has been engineered from the ground up to be (1) as high-performance as possible, (2) as configurable as possible, and (3) easy to use. PySR is developed alongside the Julia library SymbolicRegression.jl, which forms the powerful search engine of PySR. -
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JDF.jl
Julia DataFrames serialization format
JDF is a DataFrames serialization format with the following goals, fast save and load times, compressed storage on disk, enabled disk-based data manipulation (not yet achieved), and support for machine learning workloads, e.g. mini-batch, sampling (not yet achieved). JDF stores a DataFrame in a folder with each column stored as a separate file. There is also a metadata.jls file that stores metadata about the original DataFrame. Collectively, the column files, the metadata file, and the... -
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QuasiMonteCarlo.jl
Lightweight and easy generation of quasi-Monte Carlo sequences
Lightweight and easy generation of quasi-Monte Carlo sequences with a ton of different methods on one API for easy parameter exploration in scientific machine learning (SciML). This is a lightweight package for generating Quasi-Monte Carlo (QMC) samples using various different methods. -
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FEniCS.jl
A scientific machine learning (SciML) wrapper for the FEniCS
FEniCS.jl is a wrapper for the FEniCS library for finite element discretizations of PDEs. This wrapper includes three parts. Installation and direct access to FEniCS via a Conda installation. Alternatively one may use their current FEniCS installation. A low-level development API and provides some functionality to make directly dealing with the library a little bit easier, but still requires knowledge of FEniCS itself. Interfaces have been provided for the main functions and their... -
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UMAP.jl
Uniform Manifold Approximation and Projection (UMAP) implementation
A pure Julia implementation of the Uniform Manifold Approximation and Projection dimension reduction algorithm. The umap function takes two arguments, X (a column-major matrix of shape (n_features, n_samples)), n_components (the number of dimensions in the output embedding), and various keyword arguments. -
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LatticeQCD.jl
A native Julia code for lattice QCD with dynamical fermions in 4D
This code enables you to perform lattice QCD calculations! A native Julia code for Lattice QCD. -
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InMemoryDatasets.jl
Multithreaded package for working with tabular data in Julia
InMemoryDatasets.jl is a multithreaded package for data manipulation and is designed for Julia 1.6+ (64-bit OS). The core computation engine of the package is a set of customized algorithms developed specifically for columnar tables. -
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HomotopyContinuation.jl
A Julia package for solving systems of polynomials
HomotopyContinuation.jl is a Julia package for solving systems of polynomial equations by numerical homotopy continuation. Many models in the sciences and engineering are expressed as sets of real solutions to systems of polynomial equations. We can optimize any objective whose gradient is an algebraic function using homotopy methods by computing all critical points of the objective function. An important special case is when the objective function is the euclidean distance to a given point.... -
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ReservoirComputing.jl
Reservoir computing utilities for scientific machine learning (SciML)
ReservoirComputing.jl provides an efficient, modular and easy-to-use implementation of Reservoir Computing models such as Echo State Networks (ESNs). For information on using this package please refer to the stable documentation. Use the in-development documentation to take a look at not-yet-released features. -
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RCall.jl
Call R from Julia
R is a language for statistical computing and graphics that has been around for a couple of decades and it has one of the most impressive collections of scientific and statistical packages of any environment. Recently, the Julia language has become an attractive alternative because it provides the remarkable performance of a low-level language without sacrificing the readability and ease of use of high-level languages. However, Julia still lacks the depth and scale of the R package...
