Giters
Ersilia Open Source Initiative (ersilia-os)

Ersilia Open Source Initiative

ersilia-os

Geek Repo

Ersilia is a charity developing open source tools to facilitate global health drug discovery, with a focus on neglected diseases, for equal healthcare

Location:Spain

Home Page:https://ersilia.io

Twitter:@ersiliaio

Github PK Tool:Github PK Tool

Ersilia Open Source Initiative's repositories

eos2v11

ADMETlab 2 for systematic evaluation of ADMET properties

Language:PythonLicense:GPL-3.0Stargazers:7Issues:1Issues:4

eos1579

Classification of carcinogenic metabolites

Language:PythonLicense:GPL-3.0Stargazers:2Issues:1Issues:5

eos3ae7

Chemical Variational Autoencoder (VAE)

Language:PythonLicense:GPL-3.0Stargazers:2Issues:1Issues:3

eos481p

grover-toxcast

Language:PythonLicense:GPL-3.0Stargazers:2Issues:1Issues:6

eos54ij

Cardiac Toxicity Prediction

Language:PythonLicense:MITStargazers:2Issues:0Issues:0

eos9ei3

Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions

Language:PythonLicense:GPL-3.0Stargazers:2Issues:1Issues:8

eos157v

grover-freesolv

Language:PythonLicense:GPL-3.0Stargazers:1Issues:1Issues:5

eos238c

mesh-therapeutic-use

Language:PythonLicense:GPL-3.0Stargazers:1Issues:0Issues:0

eos2b6f

Language:Jupyter NotebookLicense:GPL-3.0Stargazers:1Issues:1Issues:6

eos2mrz

DeepSMILES

Language:PythonLicense:MITStargazers:1Issues:1Issues:5

eos526j

A tool for planning retrosynthesis of a target molecule based on template reactions and a stock of precursors

Language:PythonLicense:GPL-3.0Stargazers:1Issues:0Issues:0

eos69p9

Chemical toxicity prediction based on SSL-GCN

Language:PythonLicense:GPL-3.0Stargazers:1Issues:1Issues:4

eos6fza

grover-clintox

Language:PythonLicense:GPL-3.0Stargazers:1Issues:1Issues:6

eos7ack

SwissADME

Language:PythonLicense:MITStargazers:1Issues:0Issues:0

eos8451

grover-esol

Language:PythonLicense:GPL-3.0Stargazers:1Issues:0Issues:0

eos9be7

Frechet Chemnet Distance

Language:PythonLicense:GPL-3.0Stargazers:1Issues:0Issues:0

eos5qfo

Utilizes a Weisfeiler-Lehman network to predict the products of an organic reaction given the reactants

Language:PythonLicense:MITStargazers:0Issues:0Issues:0

eos7a45

Language:PythonLicense:GPL-3.0Stargazers:0Issues:1Issues:7

eos2a9n

chembl-similarity

Language:PythonLicense:GPL-3.0Stargazers:0Issues:1Issues:5

eos30gr

Language:PythonLicense:GPL-3.0Stargazers:0Issues:1Issues:4

eos3xip

grover-qm8

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos46ev

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos4b8j

GDBChEMBL Similarity Search

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos4zfy

maip-malaria

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos54c7

zinc-similarity

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos6o0z

grover-qm7

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos6pbf

selfies

Language:PythonLicense:GPL-3.0Stargazers:0Issues:1Issues:3

eos7jlv

gdbmedchem-similarity

Language:PythonLicense:GPL-3.0Stargazers:0Issues:0Issues:0

eos85a3

grover-lipo

Language:PythonLicense:GPL-3.0Stargazers:0Issues:1Issues:5

eos9c7k

ChEMBL17_DrugBank17_UNPD17 Similarity search with ECFP fingerprint

Language:PythonLicense:GPL-3.0Stargazers:0Issues:1Issues:5