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Nostrum Biodiscovery Software photo

nbdsoftware Goto Github PK

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Name: Nostrum Biodiscovery Software

Type: Organization

Bio: NBD combines in-house innovative technologies with deep industrial expertise in biomolecular modeling and leads several successful drug discovery projects.

Twitter: HelloNostrum

Blog: https://nostrumbiodiscovery.com

Nostrum Biodiscovery Software's Projects

frag_pele icon frag_pele

FrAG, a new tool for in silico hit-to-lead drug design, capable of growing a fragment into a core while exploring the protein-ligand conformational space

masif icon masif

MaSIF- Molecular surface interaction fingerprints. Geometric deep learning to decipher patterns in molecular surfaces.

peleffy icon peleffy

The peleffy (PELE Force Field Yielder) is a Python package that builds PELE-compatible force field templates.

webapp_demo1 icon webapp_demo1

This package contains the analysis script and the raw data to reproduce the results from the first demo of Nostrum's web app

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