Jefferson Richard Dias

pyADA. A cheminformatics package to perform Applicability Domain of molecular fingerprints based in similarity calculation.

pyECLAT. A package for association analysis using the ECLAT method.

pyCheckmol. Application for detecting functional groups of a molecules.

pySiRC. Simple web application for prediction of reaction rate constant through machine learning models using molecular fingerprints.

molbokeh. A new python package to visualize molecules in dots hover

SpectraFP. A package to perform fingerprints from spectroscopy datas.

spyn. A software for ssnmr shield tensors calculations based on GIPAW method, Visualization of theoretical and experimental spectra, Conformer Generator with Genetic Algorithm and Boltzmann Probability of conformers.

cronotipy. A simple customizable notification scheduler created using the python language and the pyqt5 framework for Linux systems.

WordFP. A new way to encode words and similarity calculate

thermopred. A python package to predict some thermochemical properties

scripyt-MWFN. Script to scrap text of multiwfn output

calcboltzmann. A simple GUI for boltzmann calculations

DLclass. Classification of cetones and alcohols by Deep Learning using images

hangmangame. A hangman game for terminal

pynerator. GUI for generating random passwords

template1html5css. A simple template for websites using W3 framework

sgd. An algorithm to performe gradient descent univariate

toxicidade_QSAR. Análise QSAR de toxicidade de compostos em R

learn_languages. Aprender o máximo de linguagens de programação que eu conseguir.

PyssView. A Simple GUI application to organize and store accounts/passwords.

pyopls. A Python 3 implementation of orthogonal projection to latent structures

nubcalculator. A simple Calculator using PyQt5

counterlines. Counter lines without space from multiple files