Awesome Open Source

Programming Languages

Search results for molecule molecular structures

molecular-structures x

10 search results found

Biopandas ⭐ 673

Working with molecular structures in pandas DataFrames

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

Ani1_dataset ⭐ 71

A data set of 20 million calculated off-equilibrium conformations for organic molecules

SIRIUS is a software for discovering a landscape of de-novo identification of metabolites using tandem mass spectrometry. This repository contains the code of the SIRIUS Software (GUI and CLI)

A cross-platform application for visualization of molecular databases.

Molecular Vae ⭐ 19

Pytorch implementation of the paper "Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules"

Molecular Visualization powered by Plotly

P5 Hackamol ⭐ 12

Object-Oriented Perl 5, Moose Library for Molecular Hacking

Molecule_bond_prediction ⭐ 8

Predict scalar coupling in molecules

A lightweight, 3D molecular viewer for JavaScript and PureScript applications.

Related Searches

Python Molecule (773)

Ansible Molecule (616)

Role Molecule (533)

Ansible Roles Molecule (259)

Atom Editor Molecule (235)

Javascript Molecule (169)

Molecule Chemistry (146)

Jupyter Notebook Molecule (146)

Protein Molecule (80)

Molecule Cheminformatics (79)

1-10 of 10 search results

Privacy | About | Terms | Follow Us On Twitter

Copyright 2018-2024 Awesome Open Source. All rights reserved.