Nanoinformatics: Artificial Intelligence and Nanotechnology in the New Decade

Hunting for New Drugs with AI

(2019) David H. Freedman   NATURE

A nanoinformatics decision support tool for the virtual screening of gold nanoparticle cellular association using protein corona fingerprints

(2018) Antreas Afantitis et al.   Nanotoxicology

In Silico Discovery of Plant-Origin Natural Product Inhibitors of Tumor Necrosis Factor (TNF) and Receptor Activator of NF-κB Ligand (RANKL)

(2018) Georgia Melagraki et al.   Frontiers in Pharmacology

Catalyst discovery through megalibraries of nanomaterials

(2018) Edward J. Kluender et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Decision tree models to classify nanomaterials according to the DF4nanoGrouping scheme

(2017) Agnieszka Gajewicz et al.   Nanotoxicology

The drug-maker's guide to the galaxy

(2017) Asher Mullard   NATURE

Cheminformatics-aided discovery of small-molecule Protein-Protein Interaction (PPI) dual inhibitors of Tumor Necrosis Factor (TNF) and Receptor Activator of NF-κB Ligand (RANKL)

(2017) Georgia Melagraki et al.   PLoS Computational Biology

Parametrization of nanoparticles: development of full-particle nanodescriptors

(2016) K. Tämm et al.   Nanoscale

How should the completeness and quality of curated nanomaterial data be evaluated?

(2016) Richard L. Marchese Robinson et al.   Nanoscale

Meta-analysis of cellular toxicity for cadmium-containing quantum dots

(2016) Eunkeu Oh et al.   Nature Nanotechnology

Structure-Based Repurposing of FDA-Approved Drugs as TNF-α Inhibitors

(2011) Chung-Hang Leung et al.   ChemMedChem

Structure-Based Discovery of Natural-Product-like TNF-α Inhibitors

(2010) Daniel Shiu-Hin Chan et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION