Gabriele Cruciani
Orcid: 0000-0002-4162-8692
According to our database1,
Gabriele Cruciani
authored at least 22 papers
between 2000 and 2023.
Collaborative distances:
Collaborative distances:
Timeline
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Bibliography
2023
J. Chem. Inf. Model., September, 2023
2022
An Integrated Machine Learning Model To Spot Peptide Binding Pockets in 3D Protein Screening.
J. Chem. Inf. Model., 2022
Getting Insights into Structural and Energetic Properties of Reciprocal Peptide-Protein Interactions.
J. Chem. Inf. Model., 2022
CROMATIC: <i>Cro</i>ss-Relationship <i>Ma</i>p of Cavi<i>ti</i>es from <i>C</i>oronaviruses.
J. Chem. Inf. Model., 2022
J. Chem. Inf. Model., 2022
2021
Combining machine learning and quantum mechanics yields more chemically aware molecular descriptors for medicinal chemistry applications.
J. Comput. Chem., 2021
2019
J. Comput. Aided Mol. Des., 2019
2017
PLoS Comput. Biol., 2017
2015
A Pipeline To Enhance Ligand Virtual Screening: Integrating Molecular Dynamics and Fingerprints for Ligand and Proteins.
J. Chem. Inf. Model., 2015
2013
J. Chem. Inf. Model., 2013
2012
GRID-Based Three-Dimensional Pharmacophores II: PharmBench, a Benchmark Data Set for Evaluating Pharmacophore Elucidation Methods.
J. Chem. Inf. Model., 2012
GRID-Based Three-Dimensional Pharmacophores I: FLAPpharm, a Novel Approach for Pharmacophore Elucidation.
J. Chem. Inf. Model., 2012
2010
High-Throughput Virtual Screening of Proteins Using GRID Molecular Interaction Fields.
J. Chem. Inf. Model., 2010
Molecular Interaction Fields and 3D-QSAR Studies of p53-MDM2 Inhibitors Suggest Additional Features of Ligand-Target Interaction.
J. Chem. Inf. Model., 2010
2009
Tautomer Enumeration and Stability Prediction for Virtual Screening on Large Chemical Databases.
J. Chem. Inf. Model., 2009
2008
Targeting the Conformational Transitions of MDM2 and MDMX: Insights into Dissimilarities and Similarities of p53 Recognition.
J. Chem. Inf. Model., 2008
2007
New and Original p<i>K</i><sub>a</sub> Prediction Method Using Grid Molecular Interaction Fields.
J. Chem. Inf. Model., 2007
A Common Reference Framework for Analyzing/Comparing Proteins and Ligands. Fingerprints for Ligands And Proteins (FLAP): Theory and Application.
J. Chem. Inf. Model., 2007
2004
GRIND-derived pharmacophore model for a series of α-tropanyl derivative ligands of the sigma-2 receptor<sup>*</sup>.
J. Comput. Aided Mol. Des., 2004
2001
J. Comput. Aided Mol. Des., 2001
2000
3D-QSAR methods on the basis of ligand-receptor complexes. Application of COMBINE and GRID/GOLPE methodologies to a series of CYP1A2 ligands.
J. Comput. Aided Mol. Des., 2000