Drug Response Analysis to Boolean Model Ensembles
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Updated
Nov 15, 2021 - Java
Drug Response Analysis to Boolean Model Ensembles
An SGC Open Chemistry Networks Project (number 20) dedicated to finding hits vs CHIKV nsp2 helicase based on a Virtual Screen of Enamine REAL compounds.
This project aims to develop a chemical probe of CHIKV-nsP3-macrodomain starting from a fragment screen
Contains relevant project files to publicly available tautomer database "Tautobase" for DataWarrior
📁study logs about Drug Discovery with AI
Automated processing of chemoproteomics data
Scaffolding homo sapiens enzymes inhibitors
Finding redundancies and similarities in SMILES datasets
Here you could find all of my fun and real world problems using Machine learning and Artificial Intelligence.
automating the process of finding similar approved medicines to the cognate lignads of a desired target
This repository is dedicated to the exploration and development of machine learning models for drug discovery. It serves as a platform for storing my understandings, research findings, and the progression of models aimed at identifying potential drugs for various diseases.
An SGC Chemical Networks Project devoted to the DENV Rdrp, focusing specifically on identifying a DENV reference compound
Bacterial porin permeation calculation examples for iapetus
miscellaneous of python scripts for drug discovery
Deep Learning for Chem
An artificial intelligence knowledge mining platform. #CareAlwaysInAllways
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