140 Open source projects that are alternatives of or similar to mendeleev

Periodum: An Interactive, Open-Source Periodic Table!

Periodic table, physical constants, and molecule parsing for quantum chemistry.

Library for mass spectrometry projects

Interactive Periodic Table which I made with React.js and CSS Grid. I was trying to memorize all the elements and thought, hey can I make this peculiar layout with my current CSS skills? I finally did

periodic-table.io

🧪 A comprehensive chemistry library for Python.

Learn the basics of chemistry doing the tests and using the periodic table

A box-model that automatically creates and solves equations used to describe the evolution in atmospheric composition using Python with Numba and, optionally, Fortran.

Docker setup for Bitcoin, Elements/Liquid, LND, C-Lightning, Eclair, & Electrs in regtest mode

A mobile chemistry calculator with Flutter.

A python package for Abel and inverse Abel transforms

A small ES6 library for easy sorting and filtering of elements.

A react-native TextInput, TagsInput and AutoComplete component easy to customize for both iOS and Android.

Proton Exchange Membrane (PEM) Fuel Cell Dataset

DLBFoam: An open-source dynamic load balancing model for fast reacting flow simulations in OpenFOAM. https://doi.org/10.1016/j.cpc.2021.108073

APBS & PDB2PQR - software for biomolecular electrostatics and solvation

Web Interface for ChEMBL @ EMBL-EBI

A library of free open source icons for science illustrations in biology and chemistry

Benchmark Suite for Machine Learning Interatomic Potentials for Materials

Protein-protein, protein-peptide and protein-DNA docking framework based on the GSO algorithm

A TypeScript AST Transformer that can speed up reconciliation and reduce garbage collection pressure by hoisting React elements to the highest possible scope.

Fermi quantum chemistry program

XDrawChem is a two-dimensional molecule drawing program.

Convert an xyz file into a molecular graph and create a 3D visualisation of the graph.

organic chemistry reaction prediction using NMT with Attention

CoRA Docs

Python for chemoinformatics

Automated reaction pathway search for gas-phase molecules

Build Petri net models compositionally

QUICK: A GPU-enabled ab intio quantum chemistry software package

Find similar elements

Quantum Package : a programming environment for wave function methods

extract and tweak data from electrochemical tests of cells

Graph-based molecule modeling toolkit for cheminformatics

Pytorch differentiable molecular dynamics

Scientific Computing for Chemists text for teaching basic computing skills to chemistry students using Python, Jupyter notebooks, and the SciPy stack. This text makes use of a variety of packages including NumPy, SciPy, matplotlib, pandas, seaborn, NMRglue, SymPy, scikit-image, and scikit-learn.

Teaching Utility for Classical Atomistic Simulation.

Version 3 of Chem4Word - A Chemistry Add-In for Microsoft Word

Haskell library containing isotopic masses and relative abundances for elements from Hydrogen to Bismuth and Thorium and Uranium (excluding Technetium and promethium), i.e., all elements with naturally-occurring isotopes.

🧪📈 🐍. The purpose of the panel-chemistry project is to make it really easy for you to do DATA ANALYSIS and build powerful DATA AND VIZ APPLICATIONS within the domain of Chemistry using using Python and HoloViz Panel.

A Python wrapper for the Chemistry Development Kit (CDK)

🔥 NITRO: Nitrogen Web Framework

active learning for accelerated high-throughput virtual screening

Chemistry, Gamified

Fast and scalable uncertainty quantification for neural molecular property prediction, accelerated optimization, and guided virtual screening.

The official JavaScript library for MathType, the leading formula editor and equation writer for the web by Wiris

GUI for OPEM library

Release-only repository for SCINE QCMaquis, the DMRG software from the Reiher group.

A Docker-based, cloudable platform for the development of chemoinformatics-centric web applications and microservices.

Chemoinformatics toolkit with support for inorganic molecules

A script to build reference datasets for training neural network potentials from given LAMMPS trajectories.

Molecular dynamics simulation software

Deep learning for molecules and materials book

A library for using chemistry in your applications

Bioclipse2 Core.

SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python

A PyTorch Implementation of "Optimization of Molecules via Deep Reinforcement Learning".

NeqSim is a library for calculation of fluid behavior, phase equilibrium and process simulation

Ideas for chemical similarity searches in MongoDB.

An efficient toolkit for chemical resonance analysis based on quantum chemistry calculations. It implements the quantitative theory of resonance by expansion of the wave function from a DFT/HF calculation in terms of those of the Lewis structures.