Personal Information
Organización/Lugar de trabajo
Mannheim Area, Germany Germany
Ocupación
Chemoinformatician/Software Developer
Sector
Technology / Software / Internet
Etiquetas
chemistry
chemical structure
inchi
chemical space analysis
chemical structure identifier
inchikey
chemical identifier resolver
chemical database
ncicadd
ncicadd identifiers
inchikey resolver
atom neighbourh
scaffolds
tautomers
us goverment databases
chemical identifier
chemical databases
openscience
opensource
chemoinformatics
postgres
jupyter
science
rdkit
software
git
dockerhub
docker
inchi inchikey web api resolver
resolver
databases
chemical activity predictor
qsar
chemical information
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Presentaciones
(9)Recomendaciones
(2)Cheminformatics toolkits: a personal perspective
NextMove Software
•
Hace 12 años
RDKit: Six Not-So-Easy Pieces [RDKit UGM 2016]
NextMove Software
•
Hace 8 años
Personal Information
Organización/Lugar de trabajo
Mannheim Area, Germany Germany
Ocupación
Chemoinformatician/Software Developer
Sector
Technology / Software / Internet
Etiquetas
chemistry
chemical structure
inchi
chemical space analysis
chemical structure identifier
inchikey
chemical identifier resolver
chemical database
ncicadd
ncicadd identifiers
inchikey resolver
atom neighbourh
scaffolds
tautomers
us goverment databases
chemical identifier
chemical databases
openscience
opensource
chemoinformatics
postgres
jupyter
science
rdkit
software
git
dockerhub
docker
inchi inchikey web api resolver
resolver
databases
chemical activity predictor
qsar
chemical information
Ver más