An open API service providing repository metadata for many open source software ecosystems.

GitHub topics: computational-science

RustamSubkhankulov/computational-math

MIPT DREC Computational Mathematics course labs

Language: Jupyter Notebook - Size: 6.13 MB - Last synced at: about 1 hour ago - Pushed at: about 2 hours ago - Stars: 0 - Forks: 0

NonDairyNeutrino/Thesis

Thesis for the Computational Science Master's program at Central Washington University. 3D extension of an analog of cosmological particle creation in a Friedmann-Robertson-Walker universe by numerically simulating a Bose-Einstein condensate with a time-dependent scattering length.

Language: TeX - Size: 13.9 MB - Last synced at: 1 day ago - Pushed at: 1 day ago - Stars: 2 - Forks: 0

aiidateam/aiida-core

The official repository for the AiiDA code

Language: Python - Size: 126 MB - Last synced at: 2 days ago - Pushed at: 2 days ago - Stars: 480 - Forks: 227

WLJSTeam/wolfram-js-frontend

Next-Gen Digital Notebook for Physics, Math, and Data Science. Freeware notebook environment for Wolfram Language written in Javascript

Language: HTML - Size: 440 MB - Last synced at: 3 days ago - Pushed at: 5 days ago - Stars: 403 - Forks: 20

GalerkinToolkit/GalerkinToolkit.jl

High-performance finite element toolbox in Julia

Language: Julia - Size: 47.1 MB - Last synced at: 5 days ago - Pushed at: 5 days ago - Stars: 30 - Forks: 0

lukasturcani/stk

A Python library which allows construction and manipulation of complex molecules, as well as automatic molecular design and the creation of molecular databases.

Language: Python - Size: 44.8 MB - Last synced at: 6 days ago - Pushed at: 6 months ago - Stars: 261 - Forks: 51

GLVis/glvis

Lightweight OpenGL tool for accurate and flexible finite element visualization

Language: C++ - Size: 5.87 MB - Last synced at: 6 days ago - Pushed at: 6 days ago - Stars: 283 - Forks: 52

pymc-devs/pytensor

PyTensor allows you to define, optimize, and efficiently evaluate mathematical expressions involving multi-dimensional arrays.

Language: Python - Size: 83.2 MB - Last synced at: 6 days ago - Pushed at: 9 days ago - Stars: 457 - Forks: 129

mfem/mfem

Lightweight, general, scalable C++ library for finite element methods

Language: C++ - Size: 238 MB - Last synced at: 8 days ago - Pushed at: 8 days ago - Stars: 1,881 - Forks: 526

sciris/sciris

Fast, flexible tools to simplify scientific Python

Language: Python - Size: 13.6 MB - Last synced at: 9 days ago - Pushed at: 9 days ago - Stars: 37 - Forks: 13

NonDairyNeutrino/PararealGPU.jl

A distributed and GPU-based implementation of the Parareal algorithm for parallel-in-time integration of equations of motion.

Language: Julia - Size: 647 KB - Last synced at: 8 days ago - Pushed at: 8 days ago - Stars: 1 - Forks: 0

okkevaneck/prospr

Prospr is a universal toolbox for protein structure prediction within the HP-model. The Python package is based on a C++ core, which gives Prospr its high performance. The C++ core is made available as a separate zip file to facilitate high-performance computing applications. The package comes with many prediction algorithms and datasets to use.

Language: C++ - Size: 6.64 MB - Last synced at: 10 days ago - Pushed at: 10 days ago - Stars: 17 - Forks: 1

opensim-org/opensim-core

SimTK OpenSim C++ libraries and command-line applications, and Java/Python wrapping.

Language: C++ - Size: 208 MB - Last synced at: 10 days ago - Pushed at: 10 days ago - Stars: 868 - Forks: 331

Oden-EAG/hp3d

MPI/OpenMP hp-adaptive 3D finite element software

Language: Fortran - Size: 32.5 MB - Last synced at: 9 days ago - Pushed at: 20 days ago - Stars: 25 - Forks: 3

Panadestein/blog

First atop infinity

Language: BQN - Size: 1.47 MB - Last synced at: 2 days ago - Pushed at: 12 days ago - Stars: 2 - Forks: 0

asoplata/open-science-resources

A publicly-editable collection of open science resources, including tools, datasets, meta-resources, etc.

Size: 92.8 KB - Last synced at: 10 days ago - Pushed at: over 2 years ago - Stars: 118 - Forks: 17

VIDA-NYU/reprozip

ReproZip is a tool that simplifies the process of creating reproducible experiments from command-line executions, a frequently-used common denominator in computational science.

Language: Python - Size: 19.8 MB - Last synced at: 8 days ago - Pushed at: 5 months ago - Stars: 315 - Forks: 35

INRIA/awesome-open-science-software

awesome open list of pointers about open science for software and computational science

Size: 40 KB - Last synced at: 8 minutes ago - Pushed at: 9 months ago - Stars: 146 - Forks: 19

ErillLab/average_entropy

Calculates the expected value of the entropy of a uniformly distributed sample of size N over Ω bins (or categories).

Language: Python - Size: 5.86 KB - Last synced at: 20 days ago - Pushed at: 20 days ago - Stars: 0 - Forks: 0

mehdiborji/nanoranger

simplified cellranger for long-read data

Language: Python - Size: 50.3 MB - Last synced at: 25 days ago - Pushed at: 25 days ago - Stars: 18 - Forks: 5

weijie-chen/Linear-Algebra-With-Python

Lecture Notes for Linear Algebra Featuring Python. This series of lecture notes will walk you through all the must-know concepts that set the foundation of data science or advanced quantitative skillsets. Suitable for statistician/econometrician, quantitative analysts, data scientists and etc. to quickly refresh the linear algebra with the assistance of Python computation and visualization.

Language: Jupyter Notebook - Size: 19.6 MB - Last synced at: about 1 month ago - Pushed at: 8 months ago - Stars: 2,399 - Forks: 580

ITensor/Observers.jl

Store intermediate results of iterative methods.

Language: Julia - Size: 108 KB - Last synced at: 15 days ago - Pushed at: 12 months ago - Stars: 16 - Forks: 1

americocunhajr/UERJ-UQ-CSE

Uncertainty Quantification for Computational Science and Engineering

Size: 153 MB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 3 - Forks: 2

moritzgubler/vc-sqnm

Implementation of the vc-sqnm and sqnm optimization algorithms in C++

Language: Fortran - Size: 226 KB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 5 - Forks: 0

dlr-wf/crackpy

Crack Analysis Tool in Python (CrackPy) - automatic detection and fracture mechanical analysis of (fatigue) cracks using digital image correlation

Language: Python - Size: 194 MB - Last synced at: 29 days ago - Pushed at: 9 months ago - Stars: 75 - Forks: 12

NonDairyNeutrino/ThreadPoolParty

A podcast about tricking rocks into doing science.

Language: HTML - Size: 1.22 MB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 0 - Forks: 0

gmu-cil/AIT602

Course materials about the AIT 602 Introduction to Research in Applied IT course. This course covers a broad spectrum of scientific research methods such as computational methods.

Language: Jupyter Notebook - Size: 951 KB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 3 - Forks: 13

msleigh/snes

A neutron transport mini-app with both diamond-difference and linear-discontinuous finite element spatial discretisation options

Language: Fortran - Size: 953 KB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 1 - Forks: 1

gawbul/gawbul.github.io

Homepage of Dr Stephen P. Moss, Computational Scientist

Language: HTML - Size: 1.06 MB - Last synced at: about 2 months ago - Pushed at: about 2 months ago - Stars: 2 - Forks: 0

rzxmha/Linear_Algebra

Linear Algebra project from TripleTen

Size: 1.95 KB - Last synced at: about 2 months ago - Pushed at: about 2 months ago - Stars: 0 - Forks: 0

shaanbanday/me-303-matlab-code

Advanced Engineering Mathematics

Language: MATLAB - Size: 747 KB - Last synced at: about 2 months ago - Pushed at: about 2 months ago - Stars: 0 - Forks: 0

Chaoses-Ib/ComputationalMathematics

Language: Jupyter Notebook - Size: 2.31 MB - Last synced at: about 1 month ago - Pushed at: about 2 months ago - Stars: 5 - Forks: 0

wisupai/CRESP-DOCS

CRESP (Computational Research Environment Standardization Protocol) is a standardized protocol for defining computational experiment environments, ensuring reproducibility and cross-platform consistency by specifying hardware, software, data, randomness control, version management, and automated deployment in a unified configuration file.

Language: TypeScript - Size: 0 Bytes - Last synced at: 2 months ago - Pushed at: 2 months ago - Stars: 0 - Forks: 0

realabbas/list-of-algorithms

A comprehensive curated list of algorithms🤠 🏆

Size: 82 KB - Last synced at: 2 months ago - Pushed at: over 5 years ago - Stars: 27 - Forks: 5

solvcon/solvcon

A software framework of conservation-law solvers that use the space-time Conservation Element and Solution Element (CESE) method.

Language: C++ - Size: 10.2 MB - Last synced at: 5 days ago - Pushed at: 10 months ago - Stars: 18 - Forks: 11

andthum/lintf2_ether_ana_postproc

Analysis postprocessing utilities for my molecular dynamics simulations of LiTFSI-Ether mixtures

Language: Python - Size: 1.2 MB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 0 - Forks: 0

andthum/transfer_Li

Transfer Li ions from cathode to anode in MD simulations

Language: Shell - Size: 200 KB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 2 - Forks: 0

andthum/mdtools

Scripts to prepare and analyze molecular dynamics simulations

Language: Python - Size: 12.7 MB - Last synced at: about 1 month ago - Pushed at: about 1 month ago - Stars: 9 - Forks: 2

skoohy/GPT-PINN

Generative Pre-Trained Physics-Informed Neural Networks Implementation

Language: Python - Size: 3.1 MB - Last synced at: 3 months ago - Pushed at: 3 months ago - Stars: 85 - Forks: 18

usnistgov/hiperc

High Performance Computing Strategies for Boundary Value Problems

Language: HTML - Size: 63.4 MB - Last synced at: 6 days ago - Pushed at: over 1 year ago - Stars: 42 - Forks: 10

ibralyousef/UnderGrad

My undergraduate projects

Language: Jupyter Notebook - Size: 92.2 MB - Last synced at: 3 months ago - Pushed at: 3 months ago - Stars: 3 - Forks: 0

Mehrdadghassabi/Gracc 📦

Graph theory approach for Modeling Electrical Circuits

Language: Jupyter Notebook - Size: 8.59 MB - Last synced at: 22 days ago - Pushed at: over 2 years ago - Stars: 5 - Forks: 0

Kucharssim/bayesflow-amortized-mixtures

Amortized Bayesian Mixture Models

Language: Jupyter Notebook - Size: 192 MB - Last synced at: 4 days ago - Pushed at: 4 months ago - Stars: 0 - Forks: 0

cmartinezUCSC/Resolucion_problemas_con_ADCP

Repositorio complementario para el libro digital Resolución de problemas con ADCP - Con implementación en C y Python

Language: Python - Size: 10.5 MB - Last synced at: 11 days ago - Pushed at: 4 months ago - Stars: 1 - Forks: 0

nicholasmalaya/nicholasmalaya.github.io

Public Website for Nicholas Malaya

Language: HTML - Size: 77 MB - Last synced at: 4 months ago - Pushed at: 4 months ago - Stars: 0 - Forks: 0

khinsen/leibniz-pharo

Leibniz - a Digital Scientific Notation

Language: Smalltalk - Size: 6.9 MB - Last synced at: about 1 month ago - Pushed at: 4 months ago - Stars: 33 - Forks: 3

soumyasen1809/RustODESolver

ODE Solver in Rust

Language: Rust - Size: 65.4 KB - Last synced at: 3 months ago - Pushed at: 4 months ago - Stars: 0 - Forks: 0

elcarrillo/PlumeViz

PlumeViz features a Plumeria Python wrapper, a tool designed to streamline the batch processing and analysis of 1D volcanic plume simulations using Plumeria (modern fortran version) software.

Language: Jupyter Notebook - Size: 18.8 MB - Last synced at: 3 months ago - Pushed at: 4 months ago - Stars: 0 - Forks: 0

mingscai/mineral-circuit-optimizer

A genetic algorithm-based tool designed to enhance circuit configurations for optimal recovery and purity of valuable materials in mineral processing.

Language: Jupyter Notebook - Size: 66.8 MB - Last synced at: about 1 month ago - Pushed at: 12 months ago - Stars: 0 - Forks: 0

mingscai/asteroid-impact-simulator

A simulator for analyzing the effects and hazards of small asteroids entering Earth's atmosphere.

Language: Jupyter Notebook - Size: 7.16 MB - Last synced at: about 1 month ago - Pushed at: 12 months ago - Stars: 0 - Forks: 0

sourceduty/ANNs

🧠 Computing systems using biological neural networks found in brains.

Size: 172 KB - Last synced at: 5 months ago - Pushed at: 5 months ago - Stars: 0 - Forks: 0

volpatto/firedrake_scripts

Minimal working examples applying Finite Element Method with Firedrake framework

Language: Python - Size: 329 KB - Last synced at: about 1 month ago - Pushed at: over 1 year ago - Stars: 10 - Forks: 4

yijiang1/fold_slice

Electron/X-ray ptychography and tomography/laminography

Language: MATLAB - Size: 291 MB - Last synced at: 5 months ago - Pushed at: 6 months ago - Stars: 83 - Forks: 27

sourceduty/Energy

⚛️ Energy research and technology.

Size: 860 KB - Last synced at: 5 months ago - Pushed at: 5 months ago - Stars: 0 - Forks: 0

nabilshadman/monte-carlo-simulation-equity-trading

Monte Carlo simulation toolkit for equity trading, utilizing GBM and Pareto distributions to model price movements and trading volumes

Language: Jupyter Notebook - Size: 650 KB - Last synced at: about 1 month ago - Pushed at: 5 months ago - Stars: 0 - Forks: 1

codenigma1/MITx-6.00.1x_Introduction-to-Computer-Science-and-Programming-Using-Python

An introduction to computer science as a tool to solve real-world analytical problems using Python 3.5.

Language: Python - Size: 568 KB - Last synced at: 5 months ago - Pushed at: over 4 years ago - Stars: 16 - Forks: 9

sourceduty/CPLDs

👩‍💻 A conceptual science that seeks to merge the functionalities of traditional programmable logic devices with integrated computational capabilities.

Size: 30.3 KB - Last synced at: 5 months ago - Pushed at: 5 months ago - Stars: 0 - Forks: 0

sourceduty/Computational_Metarobotics

🤖 An emerging scientific research subject that combines robotics, artificial intelligence, and computational theory to create sophisticated, autonomous robotic systems capable of higher-order reasoning and decision-making.

Language: Python - Size: 65.4 KB - Last synced at: 6 months ago - Pushed at: 6 months ago - Stars: 0 - Forks: 0

uq-group/uq-group.github.io

UQ Group (Director: Hadi Meidani)

Language: CSS - Size: 12.8 MB - Last synced at: 6 months ago - Pushed at: 6 months ago - Stars: 1 - Forks: 0

mtakaendengan/mtakaendengan.github.io

Language: JavaScript - Size: 50.4 MB - Last synced at: 6 months ago - Pushed at: 6 months ago - Stars: 1 - Forks: 1

Subhasis-Biswas/PlacementExperiences

Placement Experiences of IISc CDS 2024

Size: 3.19 MB - Last synced at: 6 months ago - Pushed at: 6 months ago - Stars: 0 - Forks: 0

aromanro/PythonCompphys

Some python workbooks with various topics from Computational Physics

Language: Jupyter Notebook - Size: 62.4 MB - Last synced at: about 1 month ago - Pushed at: about 2 years ago - Stars: 59 - Forks: 12

sourceduty/New_Science_Subjects

🧑‍🔬 Newly created, original emerging scientific theories, frameworks with concepts.

Size: 326 KB - Last synced at: 7 months ago - Pushed at: 7 months ago - Stars: 0 - Forks: 0

Skygers/Computational-Geophysics-series

A series of computational tools (works) for modeling, simulating, and analyzing geophysical field

Language: Jupyter Notebook - Size: 753 KB - Last synced at: 8 months ago - Pushed at: 8 months ago - Stars: 0 - Forks: 0

sourceduty/Computational_Cyberdynamics

👩‍💻 An original emerging scientific concept that explores the interaction between cybernetic systems and dynamic computational processes.

Size: 182 KB - Last synced at: 8 months ago - Pushed at: 8 months ago - Stars: 0 - Forks: 0

ITSUREN/Theory-of-Computation

📚 A repository on Theory of Computation and it's implementation for Academic purpose

Language: C - Size: 2.38 MB - Last synced at: 2 months ago - Pushed at: 8 months ago - Stars: 0 - Forks: 0

resendislab/resendislab.github.io

The (rendered) website of the Resendis lab. Do not send PRs here! Use https://github.com/resendislab/website instead!

Language: HTML - Size: 73.6 MB - Last synced at: 8 months ago - Pushed at: 8 months ago - Stars: 0 - Forks: 0

Been-Noman/High-Performance-Computing

High Performance Computing

Size: 3.91 KB - Last synced at: 8 months ago - Pushed at: 8 months ago - Stars: 0 - Forks: 0

tycho-kirchner/shournal

Log shell-commands and used files. Snapshot executed scripts. Fully automatic.

Language: C++ - Size: 2.7 MB - Last synced at: 9 months ago - Pushed at: 9 months ago - Stars: 167 - Forks: 9

sourceduty/Cyberdiagnostic_Physics

🧑‍🔬 An emerging scientific concept that amalgamates principles of cybernetics, diagnostics, and physics to develop new methodologies for analyzing and understanding complex systems.

Size: 10.7 KB - Last synced at: 9 months ago - Pushed at: 9 months ago - Stars: 0 - Forks: 0

ese-msc/introduction-to-python

"Introduction to Python" course for future Imperial College London MSc students

Language: Jupyter Notebook - Size: 414 KB - Last synced at: 9 months ago - Pushed at: 9 months ago - Stars: 67 - Forks: 70

sourceduty/Computational_Microcontrollers

👨‍💻 An original emerging scientific concept that examines controlled virtual environments for the definition and simulation of microcontrollers.

Size: 188 KB - Last synced at: 9 months ago - Pushed at: 9 months ago - Stars: 0 - Forks: 0

elcarrillo/magma-project

python scripts to analyze and plot petrological data

Language: Python - Size: 1.42 MB - Last synced at: 3 months ago - Pushed at: 10 months ago - Stars: 0 - Forks: 2

VIDA-NYU/reprozip-examples

Examples and demos for ReproZip

Language: HTML - Size: 30.1 MB - Last synced at: about 2 months ago - Pushed at: over 2 years ago - Stars: 16 - Forks: 6

tgautam03/Computational-Sciences

Understand how Computers solve PDEs

Language: Jupyter Notebook - Size: 22.7 MB - Last synced at: about 2 months ago - Pushed at: about 1 year ago - Stars: 0 - Forks: 1

ReScience/ReScience

The ReScience journal. Reproducible Science is Good. Replicated Science is better.

Size: 64.5 KB - Last synced at: 9 months ago - Pushed at: almost 3 years ago - Stars: 697 - Forks: 36

ZhanZiyuan/PyUtilities

Useful functions and classes in Python programming.

Language: Python - Size: 85.9 KB - Last synced at: 2 months ago - Pushed at: 10 months ago - Stars: 0 - Forks: 0

JuDFTteam/aiida-jutools

Tools for simplifying daily work with the AiiDA workflow engine

Language: Python - Size: 36.3 MB - Last synced at: 28 days ago - Pushed at: 10 months ago - Stars: 6 - Forks: 6

ucla-oarc-cs/ucla-oarc-cs.github.io

Computational Science Group Web Site. Jus the HTML files.

Language: HTML - Size: 4.53 MB - Last synced at: 10 months ago - Pushed at: 10 months ago - Stars: 0 - Forks: 1

sthavishtha/list-lattice-Boltzmann-codes

Curated list of some open source codes employing lattice Boltzmann methods

Size: 77.1 KB - Last synced at: 10 months ago - Pushed at: 10 months ago - Stars: 169 - Forks: 43

seansovine/numerical_projects

Projects in computational math and image processing.

Language: C++ - Size: 2.41 MB - Last synced at: 10 months ago - Pushed at: 10 months ago - Stars: 0 - Forks: 0

salvoronis/RiemmanSum

Riemman sum in golang

Language: Go - Size: 167 KB - Last synced at: about 2 years ago - Pushed at: about 5 years ago - Stars: 0 - Forks: 0

ejhusom/FYS3150

Source code for the course FYS3150 Computational Physics at University of Oslo.

Language: C++ - Size: 13.7 MB - Last synced at: 11 months ago - Pushed at: over 5 years ago - Stars: 1 - Forks: 0

RexGalilae/vasp-tools

A suite of scripts and modules that perform menial, tedious and repetitive tasks and operations on VASP files that were hurriedly and haphazardly put together by some intern.

Language: Python - Size: 11.2 MB - Last synced at: 12 months ago - Pushed at: 12 months ago - Stars: 9 - Forks: 3

AyFait/ayobamisonibare.github.io

Herein lies what I'm made to do and how I get them done

Size: 4.88 KB - Last synced at: 12 months ago - Pushed at: about 1 year ago - Stars: 0 - Forks: 0

OpenDreamKit/OpenDreamKit

Main repository for sharing files and documents about OpenDreamKit

Language: TeX - Size: 468 MB - Last synced at: about 1 year ago - Pushed at: over 4 years ago - Stars: 90 - Forks: 42

zachpinto/leetcode

My personal collection of leetcode and computational problems implemented in python

Language: Python - Size: 191 KB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 1 - Forks: 0

pycnic/pycnic.github.io

The Pycnic

Language: HTML - Size: 1.24 MB - Last synced at: about 1 year ago - Pushed at: about 8 years ago - Stars: 0 - Forks: 0

nagarx/Using_Simulated_Annealing_for_the_Traveling_Salesman_Problem

Implementation of the Simulated Annealing (SA) algorithm to tactically solve the Traveling. The project involves constructing an adjacency matrix to model inter-city distances, iteratively refining solutions through stochastic alterations influenced by a dynamically adjusted temperature parameter, and employing the Metropolis acceptance criterion.

Language: Jupyter Notebook - Size: 547 KB - Last synced at: about 1 year ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

yoavram/python.yoavram.com

Python Training Website

Language: HTML - Size: 9.99 MB - Last synced at: about 1 year ago - Pushed at: almost 4 years ago - Stars: 0 - Forks: 1

OpenSourceEconomics/ose-promotion 📦

promotional material for our initiative

Language: TeX - Size: 23.9 MB - Last synced at: about 1 year ago - Pushed at: almost 3 years ago - Stars: 1 - Forks: 1

davidssmith/rawarray-rust

Rust implementation of the RawArray file format

Language: Rust - Size: 151 KB - Last synced at: about 1 month ago - Pushed at: about 5 years ago - Stars: 1 - Forks: 0

ConsenSysMesh/hellhound-vm

Language: Go - Size: 52.7 KB - Last synced at: about 1 month ago - Pushed at: over 6 years ago - Stars: 7 - Forks: 4

Computer-Kurzweil/diffusion-limited-aggregation

Diffusion-limited aggregation (DLA) is the process whereby particles undergoing a random walk due to Brownian motion cluster together to form aggregates of such particles.

Language: Java - Size: 1.2 MB - Last synced at: about 1 year ago - Pushed at: almost 2 years ago - Stars: 5 - Forks: 0

pradeepsinngh/Numerical-Optimization-Notes

My notes and implementation of different numerical optimization algorithms.

Language: Jupyter Notebook - Size: 169 KB - Last synced at: about 1 year ago - Pushed at: over 6 years ago - Stars: 1 - Forks: 0

elfi-dev/notebooks

Notebook tutorials

Language: Jupyter Notebook - Size: 11 MB - Last synced at: about 1 year ago - Pushed at: over 1 year ago - Stars: 13 - Forks: 8

Sabaoon96/University-of-Auckland

Coursework Projects

Language: Jupyter Notebook - Size: 11.8 MB - Last synced at: about 1 year ago - Pushed at: almost 7 years ago - Stars: 0 - Forks: 0

2AUK/pyRISM

Implementation of the Reference Interaction-Site Model (RISM) equation

Language: Rust - Size: 628 MB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 12 - Forks: 1

yoavram/Py4Eng

Python for Engineers

Language: Jupyter Notebook - Size: 129 MB - Last synced at: about 2 months ago - Pushed at: about 2 months ago - Stars: 24 - Forks: 32

VoidKeishi/Computational-Science

This repository contains implementations of algorithms from the course "Computational Science" at HUST

Language: Python - Size: 16.6 KB - Last synced at: about 1 month ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

Related Keywords
computational-science 202 python 42 scientific-computing 32 computational-physics 24 data-science 24 science 15 computer-science 14 computational-chemistry 13 numerical-methods 12 materials-science 12 computational-biology 11 python3 11 machine-learning 11 physics 11 simulation 10 research 8 hpc 8 ai 8 artificial-intelligence 8 chemistry 7 high-performance-computing 7 numerical-analysis 7 java 7 reproducible-research 7 numpy 6 mathematics 6 computational 6 bioinformatics 6 linear-algebra 5 computational-fluid-dynamics 5 reproducibility 5 theory 5 matlab 5 ode-solver 5 parallel-computing 5 julia 5 finite-elements 4 math 4 bayesian-inference 4 deep-learning 4 algorithms 4 matplotlib 4 reproducible-science 4 open-science 4 cpp 4 numerical-simulations 4 new-science 4 george-mason-university 4 jupyter-notebook 4 gpt 4 rust 4 workflow 4 molecular-simulation 4 molecular-modeling 4 aiida 4 cds-101 4 computation 3 mathematical-modelling 3 docker 3 density-functional-theory 3 programming 3 r 3 concept 3 monte-carlo 3 julia-language 3 turing-machine 3 quantum-mechanics 3 matrix-calculations 3 tutorial 3 numerical-optimization 3 partial-differential-equations 3 scientist 3 finite-difference 3 modeling 3 scipy 3 pde-solver 3 python-scripts 3 molecular-mechanics 3 molecular-dynamics 3 computational-mathematics 3 mdanalysis 3 sciences 3 gpu-computing 3 cuda 3 statistics 3 golang 3 fem 3 finite-element-methods 3 ode 3 provenance 3 differential-equations 3 fractal 3 desktop 3 modelling 2 fortran 2 graph-theory 2 optimization-algorithms 2 quantum 2 molecular-evolution 2 c 2