Search Results for "open-shell" - Page 10
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Showing 1903 open source projects for "open-shell"
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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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DataStructures.jl
Julia implementation of Data structures
Julia implementation of Data structures. -
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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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SatelliteToolbox.jl
A toolbox for satellite analysis written in julia language
The SatelliteToolbox.jl contains a set of packages with functions to perform analysis and build simulations related to satellites. It is used on a daily basis on projects at the Brazilian National Institute for Space Research (INPE). -
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LanguageServer.jl
An implementation of the Microsoft Language Server Protocol
This package implements the Microsoft Language Server Protocol for the Julia programming language. Text editors with a client for the Language Server Protocol are able to make use of the Julia Language Server for various code editing features. -
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visx
Visualization components
visx a collection of expressive, low-level visualization primitives for React. At Airbnb, we made it a goal to unify our visualization stack across the company and in the process, we created a new project that brings together the power of D3 with the joy of React. visx is split into multiple packages. Start small and use only what you need. Bring your own state management, animation library, or CSS-in-JS solution. Odds are good your React app already has an opinion on how animation, theming,... -
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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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Metal.jl
Metal programming in Julia
With Metal.jl it's possible to program GPUs on macOS using the Metal programming framework. The package is a work in progress. There are bugs, functionality is missing, and performance hasn't been optimized. Expect to have to make changes to this package if you want to use it. PRs are very welcome. These requirements are fairly strict, and are due to our limited development resources (manpower, hardware). Technically, they can be relaxed. If you are interested in contributing to this, see... -
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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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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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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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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... -
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Infiltrator.jl
No-overhead breakpoints in Julia
This package provides the @infiltrate macro, which acts as a breakpoint with negligible runtime performance overhead. Note that you cannot access other function scopes or step into further calls. Use an actual debugger if you need that level of flexibility. Running code that ends up triggering the @infiltrate REPL mode via inline evaluation in VS Code or Juno can cause issues, so it's recommended to always use the REPL directly. When the infiltration point is hit, it will drop you into an... -
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ChainRules.jl
Forward and reverse mode automatic differentiation primitives
The ChainRules package provides a variety of common utilities that can be used by downstream automatic differentiation (AD) tools to define and execute forward-, reverse--, and mixed-mode primitives. The core logic of ChainRules is implemented in ChainRulesCore.jl. To add ChainRules support to your package, by defining new rules or frules, you only need to depend on the very light-weight package ChainRulesCore.jl. This repository contains ChainRules.jl, which is what people actually use... -
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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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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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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.
