http://publicationslist.org/data/flavioballante/atom.xmlFlavio Ballante's Publications List
Flavio Ballante//publicationslist.org/flavioballante$basepathfavicon.icoRecent additions to Flavio Ballante's PublicationsList.org page//publicationslist.org/publications.png2026-04-17T13:19:43Z
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2026-04-17T13:18:28Z
From library to landscape: integrative annotation workflows for compound libraries in drug repurposing.
In the rapidly advancing landscape of drug discovery and repurposing, efficient access and integration of chemical and bioactivity data from public repositories have become essential. To address this need, we developed two complementary annotation pipelines (KNIME- and Python-based) that automate the extraction and integration of curated chemical and bioactivity data from public repositories. Thes...<br/><br/>Jeanette Reinshagen, Brinton Seashore-Ludlow, Yojana Gadiya, Anna-Lena Gustavsson, Ziaurrehman Tanoli, Tero Aittokallio, Johanna Huchting, Annika Jenmalm-Jensen, Philip Gribbon, Andrea Zaliani, Flavio Ballante (2025) <i>Database : the journal of biological databases and curation</i> <i></i> <i></i> 2025: <br/>
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2026-04-17T13:18:28Z
Development of an G Protein-Coupled Receptor Fragment Molecule Screening Approach with High-Resolution Magic Angle Spinning Nuclear Magnetic Resonance.
Small molecules are essential for investigating the pharmacology of membrane proteins and remain the most common approach for therapeutically targeting them. However, most experimental small molecule screening methods require ligands containing radiolabels or fluorescent labels and often involve isolating proteins from their cellular environment. Additionally, most conventional screening methods a...<br/><br/>Enzo Petracco, Guillaume Ferré, Ivo Kabelka, Flavio Ballante, Jens Carlsson, Emma Mulry, Arka P Ray, James Collins, Florent Allais, Matthew T Eddy (2025) <i>ACS chemical biology</i> <i></i> <i></i> 20: 2 401-411<br/>
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2026-04-17T13:18:28Z
Structure-Based Virtual Screening for Ligands of G Protein-Coupled Receptors: What Can Molecular Docking Do for You?
G protein-coupled receptors (GPCRs) constitute the largest family of membrane proteins in the human genome and are important therapeutic targets. During the last decade, the number of atomic-resolution structures of GPCRs has increased rapidly, providing insights into drug binding at the molecular level. These breakthroughs have created excitement regarding the potential of using structural inform...<br/><br/>Flavio Ballante, Albert J Kooistra, Stefanie Kampen, Chris de Graaf, Jens Carlsson (2021) <i>Pharmacological reviews</i> <i></i> <i></i> 73: 4 527-565<br/>