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anatolia

NMR spectra total lineshape analysis program http://anatolia.nmrclub.ru

ansurr

ANSURR | Accuracy of NMR Structures Using RCI and Rigidity

arduitam

Arduino-based automatic NMR/MRI tuning and matching system

autometabolism

autopiano

自由钢琴 AutoPiano，喜欢可以star ( http://crystalworld.gitee.io/qpiano/#/ )

avogadro

Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible rendering and a powerful plugin architecture.

blogsource

cascade

CAlculation of NMR using Deep LEarning

ccpnmr2.4

chem-spectra-app

A backend web service provides NMR/IR/MS processing for jcamp/RAW/mzML files.

csi_lstm

Predict protein secondary structure from NMR chemical shifts, using LSTM neural network

deep

ANN based NMR peak picker

deepmind-research

This repository contains implementations and illustrative code to accompany DeepMind publications

deploy

Pandora Cloud + Pandora Server + Shared Chat + BackendAPI Proxy = PandoraNext. New GPTs(Gizmo) UI, All in one!

deskhop

Fast Desktop Switching Device

dosy_net

DOSY processing

fftw.jl

Julia bindings to the FFTW library for fast Fourier transforms

fluxionalize

An open source conformational search method.

gogs

Gogs is a painless self-hosted Git service

hose_code_generator

Generating HOSE codes of molecules with Python

inkscape-raytracing

jspectra_viewer

JavaScript library for viewing spectra

luckysheet

Luckysheet is an online spreadsheet like excel that is powerful, simple to configure, and completely open source.

misago

Misago is fully featured modern forum application that is fast, scalable and responsive.

molminer

Python library and command-line tool for extracting compounds from scientific literature. Written in Python.

molsketch

Molsketch 2D molecular editor

myblog

netlify-cms

A CMS for Static Site Generators

nmr-ts

Molecule identifier from NMR spectrum using de novo molecule generator

nmr.jl

NMR processing in Julia