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Open-source online virtual screening tools for large databases
PyMOL-wasm port's binary and html/javascript code
nmrML is an open mark-up language for NMR data. This is the official repository for development of the nmrML schema and NMR ontology.
Python snippets for PyMOL to be run in Jupyterlab via the jupyterlab-snippets-multimenus extension.
An interactive for visualizing complex functions based on a 3Blue1Brown video and also estimation of Riemann Zeta Function using Euler Maclaurin Summation.
A collection of code for creating music / synthetic sound with javascript.
CoV-Seq: COVID-19 Genomic Sequence Database and Visualization
XMLPipeDB is a suite of tools for building relational databases from XML sources with minimal manual processing of the data. While the applicability is general, our motivation was to facilitate the…
Algorithms in Bioinformatics - MSc in Bioinformatics - University of Crete
A comprehensive machine learning repository containing 30+ notebooks on different concepts, algorithms and techniques.
This tutorials aim to illustrate the process of protein-ligand docking, step by step, using the BioExcel Building Blocks library (biobb).
A web app solving Poisson's equation in electrostatics using finite difference methods for discretization, followed by gauss-seidel methods for solving the equations. Dirichlet conditions and charg…
Simple simulator of Windows 3.1 (it's just a toy)
Deep Learning with Keras in R workshops
Data Science Repo and blog for John Hopkins Coursera Courses. Please let me know if you have any questions.
Analysis of insertions in the genomes and proteins of coronaviruses. Illustration: AvH. (2020). Covid-19 cracked <http://doi.org/10.5281/zenodo.3734643>
Code used to query the Metlin database for mass and MSn data
Statistical analysis of Touret's in vitro screening for molecules inhibiting SARS-CoV-2 infection. Illustration: AvH. (2020). Covid-19 cracked (http://doi.org/10.5281/zenodo.3734643).
Analysis scripts for the IDG-DREAM Drug Kinase Binding Prediction Challenge
Predicts weather of your city on the basis of input paramters provided.
Mengjintao / chemprop
Forked from chemprop/chempropMessage Passing Neural Networks for Molecule Property Prediction
Some scripts (mainly Python 3) which I made during my studies of Bioinformatics at University of Chemistry and Technology in Prague (http://www.vscht.cz/?jazyk=en)