Area of research
Molecular Biology · Materials Chemistry
Research interest
Research interests include Computer science, Docking (animal), Computational biology, Benchmark (surveying), CASP, and Interface (matter).
HADDOCK3: A Modular and Versatile Platform for Integrative Modeling of Biomolecular Complexes
The HADDOCK2.4 web server for integrative modeling of biomolecular complexes
Impact of <scp>AlphaFold</scp> on structure prediction of protein complexes: The <scp>CASP15‐CAPRI</scp> experiment
Rational Prediction of PROTAC-Compatible Protein–Protein Interfaces by Molecular Docking
Discriminating physiological from non‐physiological interfaces in structures of protein complexes: A community‐wide study
Impact of AlphaFold on Structure Prediction of Protein Complexes: The CASP15-CAPRI Experiment
Discriminating physiological from non-physiological interfaces in structures of protein complexes: a community-wide study
Towards design of drugs and delivery systems with the Martini coarse-grained model
Structural Biology in the Clouds: The WeNMR-EOSC Ecosystem
Prediction of protein assemblies, the next frontier: The <scp>CASP14‐CAPRI</scp> experiment
Structural Biology in the Clouds: The WeNMR-EOSC Ecosystem
Integrative modeling of membrane-associated protein assemblies
proABC-2: PRediction of AntiBody contacts v2 and its application to information-driven docking
<scp>PDB‐tools</scp> web: A user‐friendly interface for the manipulation of <scp>PDB</scp> files
Modeling Antibody-Antigen Complexes by Information-Driven Docking
PRODIGY-crystal: a web-tool for classification of biological interfaces in protein complexes
LightDock goes information-driven
pyDockEneRes: per-residue decomposition of protein–protein docking energy
SKEMPI 2.0: an updated benchmark of changes in protein–protein binding energy, kinetics and thermodynamics upon mutation
IRaPPA: information retrieval based integration of biophysical models for protein assembly selection
Prediction of homoprotein and heteroprotein complexes by protein docking and template‐based modeling: A CASP‐CAPRI experiment
Updates to the Integrated Protein–Protein Interaction Benchmarks: Docking Benchmark Version 5 and Affinity Benchmark Version 2
Community-wide evaluation of methods for predicting the effect of mutations on protein-protein interactions
Blind prediction of interfacial water positions in CAPRI