Phi GRIB

PharmacoInformatics laboratory at GRIB (UPF)

Barcelona

Pinned Repositories

Data_curation
Python code for handling data curation: SMILES of problematic molecules, dataset selection, train and test split.
Language:Python6 3 41
eTOXlab
Language:Python6 9 27
flame
Modeling framework for eTRANSAFE project
Language:Python12 5 13710
flame_API
Backend flame web service
Language:JavaScript2 3 90
Hepatoxicity-SysBio
Language:Jupyter Notebook1 3 02
Itex_codes
Codes used to generate the DB and replicate USC workflow
Language:Python1 2 120
PaDEL-descriptor-ws
PaDEL ws descriptors engine
Language:Shell12 4 36
phitools
Language:Python0 6 21
RDTExtractorWeb
Language:JavaScript0 2 22
TOXTRUST
Dempster-Shafer Theory based python tool for processing toxicological evidence pieces, combining them to a single result, and estimating their uncertainties.
Language:Python3 4 00

Phi GRIB's Repositories

phi-grib/flame
Modeling framework for eTRANSAFE project
Language:Python12 5 13710
phi-grib/Data_curation
Python code for handling data curation: SMILES of problematic molecules, dataset selection, train and test split.
Language:Python6 3 41
phi-grib/TOXTRUST
Dempster-Shafer Theory based python tool for processing toxicological evidence pieces, combining them to a single result, and estimating their uncertainties.
Language:Python3 4 00
phi-grib/flame_API
Backend flame web service
Language:JavaScript2 3 90
phi-grib/compoundDB
Language:Python1 3 11
phi-grib/Curation_workflow
Wokflow intended to download data from ChEMBL and prepare it for modelling in Flame
Language:Jupyter Notebook1 2 01
phi-grib/Itex_codes
Codes used to generate the DB and replicate USC workflow
Language:Python1 2 120
phi-grib/cardioML
Language:Jupyter Notebook0 1 00
phi-grib/flame_installer_windows
Language:Rich Text Format0 2 10
phi-grib/phitools
Language:Python0 6 21
phi-grib/chembl_data_extraction
Language:Jupyter Notebook1 0
phi-grib/Cholestasis_paper
Language:Jupyter Notebook1 0
phi-grib/comptox_analysis
Language:Jupyter Notebook
phi-grib/ED_RAX
Jupyter notebook for Endocrine Disruptor Read Accross
Language:Jupyter Notebook2 0
phi-grib/EPA_simplified
EPA code for CAS structure resolution
Language:Jupyter Notebook2 0
phi-grib/Flame_installer_linux
Bash scripts for installing Flame and miniconda
Language:Shell2 01
phi-grib/flameWeb
Language:HTML1 14
phi-grib/flameWeb2
Angular frontend for flame
Language:TypeScript2 01
phi-grib/flameWeb3
Angular frontend for flame
Language:TypeScript2 0
phi-grib/Itex_codes_refactorized
Language:Python1 0
phi-grib/multi-select
An unofficial mirror for multi-select javascript library
Language:JavaScript3 0
phi-grib/namastox
Language:Python1 0
phi-grib/namastox_API
Language:Python
phi-grib/namastox_web
Language:HTML
phi-grib/nonconformist
Python implementation of the conformal prediction framework.
Language:Python1 0
phi-grib/pivot-test
Repository with an example of implementation for pivottable.js
Language:TypeScript3 0
phi-grib/RAcount
Language:TypeScript2 0
phi-grib/RAcountServer
Language:JavaScript3 0
phi-grib/standardiser
Molecular standardisation tool
Language:Jupyter Notebook3 0
phi-grib/Virtual_Control_Groups
Code to handle VCG from eTRANSAFE project
Language:Python2 0