fraunhofer-itmp Goto Github PK

alister

ALISTER

amr-kg

A knowledge graph of experimental drug data for anti-microbial resistant strains.

bpo

BPO: An application ontology for extending interoperability for in-vivo bioassay protocols relevant to antimicrobial resistance (AMR) drug discovery.

by-covid-kg

cml_benchmarks

covid-nmr-kg

A Knowledge graph representation of COVID-NMR data

e3_binder_model

Source code and dataset for paper titled "Pharmacophore-based ML model to predict ligand selectivity for E3 ligase binders"

e3_binder_model_2

Source code and data repository for "Pharmacophoric-based ML model to filter candidate E3 ligands and predict E3 Ligase binding probabilities"

imi-project-prioritization

Code and data repository for selection of datasets for FAIRification in Drug Discovery and Development.

kgg

An automated workflow to create disease-specific Knowledge Graphs

knime

KNIME workflows for High Content Screening and High-Throughput Screening analysis

knime-fairplus

Workflow for IMI project data collection and selection.

mpox-kg

Source code and data repository for paper titled "Monkeypox Knowledge Graph: A comprehensive representation embedding chemical entities and associated biology of Monkeypox "

patent-clinical-candidate-characteristics

Source code and data repository for paper titled "Exploring SureChEMBL from a drug discovery perspective".

pemt

Source code and data files for "PEMT: A patent enrichment tool with applicability in drug discovery"

pharmaceutical-patent-landscaping

Source code and data files for manuscript titled "Pharmaceutical patent landscaping: A novel approach to understand patents from the drug discovery perspective"

protackb

python codes and data

protacspace

A reposity for exploring the PROTACs chemical space

sasc

SASC: A Simple Approach to Synthetic Cohorts for generating longitudinal observational patient cohorts from COVID-19 clinical data