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Publications by Fabio Pietrucci
Holo-Like and Druggable Protein Conformations From Enhanced-Sampling of Binding Pocket Shape
Journal of Chemical Information and Modeling
Computer Science Applications
Chemistry
Chemical Engineering
Library
Information Sciences
HIV-1 Protease Dimerization Dynamics Reveals a Transient Druggable Binding Pocket at the Interface
Scientific Reports
Multidisciplinary
Related publications
Conformational Transitions Upon Ligand Binding: Holo Structure Prediction From Apo Conformations
Biophysical Journal
Biophysics
Understanding Cryptic Pocket Formation in Protein Targets by Enhanced Sampling Simulations
Surface-Based Protein Binding Pocket Similarity
Proteins: Structure, Function and Genetics
Biochemistry
Structural Biology
Molecular Biology
Flexible Backbone Sampling Methods to Model and Design Protein Alternative Conformations
Methods in Protein Design
POVME 2.0: An Enhanced Tool for Determining Pocket Shape and Volume Characteristics
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
Structures of the Substrate-Binding Protein YfeA in Apo and Zinc-Reconstituted Holo Forms
Acta Crystallographica Section D: Structural Biology
Structural Biology
High-Resolution Cryo-Em Maps Show the Nucleotide Binding Pocket of KIF1A in Open and Closed Conformations
EMBO Journal
Immunology
Molecular Biology
Biochemistry
Microbiology
Neuroscience
Medicine
Genetics
Oligopeptide-Binding Protein From Nontypeable Haemophilus Influenzae Has Ligand-Specific Sites to Accommodate Peptides and Heme in the Binding Pocket
Journal of Biological Chemistry
Biochemistry
Cell Biology
Molecular Biology
