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awesome-python

A curated list of awesome Python frameworks, libraries, software and resources

bertelsmann-ai-track-notes

A simple repo to upload my notes from the Bertelsmann AI track, Udacity.

biologia_y_quimica_basica

Página de ejercicios de Biología y Química básica. En proceso de refactorización y actualización.

bokeh_data_visualization

cdk2_md_gromacs

Prepare and analyze MD simulations using python, biobb, AmberTools, and GROMACS.

cdk2_notebooks

covid_mexico_tracker

A Shinny App for tracking COVID-19 cases in Mexico 🇲🇽 . Developed using R, Plotly, Leaflet, and Shinny.

curso_introduccion_a_r

Curso de introducción a R

dash_app_heroku_ml_docking_scores

A Dash/plotly app deployed on heroku. Combines different plots and visualization to explore Machine Learning model performances.

e6_hpv_protein_data_analysis

Protocolos usados en la Tesis de Maestría (2017)

eda-transcriptomic

It is a exploratory data analysis (EDA) dashboard than can be used at leats with an DESeqDataSet class objects and csv metadata

erk2_notebooks

fairyonice.github.io

fxa-notebooks

Notebook to Analyze Ensemble Docking Protocols over FXa protein

geometry_analysis

A sample package for the MolSSI software summer school

learning_emotions_with_emojis

Predict human emotions in tweets by mapping emojis into the Valence-Arousal space (Russell, 2005). LSTM models the sequence learning of words within the tweets.

md_namd_python

Molecular Dynamics with namd2 and python

mexico-covid-19

Base de datos de los casos de COVID-19 reportados en México. Database of the cases of COVID-19 reported in Mexico.

ml-ensemble-docking

Improving Structure-Based Virtual Screening with Ensemble Docking and Machine Learning

ml_and_datascience_projects

Un conjunto de proyectos de Machine Learning y Deep Learning (con contenido en español) que ido implementado durante mi aprendizaje.

my-obsidian-digital-garden

My digital garden 🌿. A personal Wiki to keep notes related to Machine Learning and Data Science.

poster-proteinscnn-webapp

Interactive web app developed using dash and python. Deployed on Heroku.

python-guide

Python best practices guidebook, written for humans.

python-package-best-practices

https://molssi-education.github.io/python-package-best-practices/

qvina

Accurately speed up AutoDock Vina

school-managemet-system

scikit-chem

A high level cheminformatics package for the Scientific Python stack, built on RDKit.

shiny_app_consensus_ml_scorings

This a shiny app to show and compare results from Consensus and ML docking scores.

taller_simulacion_molecular

Taller de docking molecular y dinámica molecular

treeviz

Visualization of sklearn's DecisionTree using networkx and bokeh