MolPred - Inria - Institut national de recherche en sciences et technologies du numérique

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Software Year : 2023

MolPred

(1, 2)

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Jan-Michael Rye

Function : Author
PersonId : 1295903
IdHAL : mike-rye
ORCID : 0009-0005-0109-6598

Inria Lyon

La pharmacologie des neurones et des astrocytes à l’aide des sciences du numérique

Abstract

A framework for building machine- and deep-learning predictors for molecular characteristics using Hydronaut and Chemfeat.

Keywords

Python Machine Learning Deep Learning Molecules Drugs

Domains

Artificial Intelligence [cs.AI]

Jan-Michael Rye : Connect in order to contact the contributor

https://hal.science/hal-04248217

Submitted on : Wednesday, October 18, 2023-3:28:20 PM

Last modification on : Friday, October 20, 2023-3:37:36 AM

Dates and versions

hal-04248217 , version 1 (18-10-2023)

Identifiers

HAL Id : hal-04248217 , version 1
SWHID : swh:1:dir:30804037d1dfde5004422d725625b765d5e68101;origin=https://gitlab.inria.fr/jrye/molpred.git;visit=swh:1:snp:401a0b556180686321959104732de8127df4f235;anchor=swh:1:rev:5dd0d37ab787a10a0b3baa55e685c7c83a8071f0

version : 2023.5
Software License : http://spdx.org/licenses/MIT
Programming Language : Python
Code Repository : https://gitlab.inria.fr/jrye/molpred

Cite

Jan-Michael Rye. MolPred. 2023, ⟨swh:1:dir:30804037d1dfde5004422d725625b765d5e68101;origin=https://gitlab.inria.fr/jrye/molpred.git;visit=swh:1:snp:401a0b556180686321959104732de8127df4f235;anchor=swh:1:rev:5dd0d37ab787a10a0b3baa55e685c7c83a8071f0⟩. ⟨hal-04248217⟩

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