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Anna Vulpetti
ORCID
Publication Activity (10 Years)
Years Active: 1994-2024
Publications (10 Years): 1
Top Topics
High Precision
Probabilistic Model
Drug Discovery
Top Venues
J. Chem. Inf. Model.
J. Comput. Aided Mol. Des.
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Publications
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Patrick Penner
,
Anna Vulpetti
F NMR chemical shift prediction.
J. Comput. Aided Mol. Des.
38 (1) (2024)
Tuomo Kalliokoski
,
Tjelvar S. G. Olsson
,
Anna Vulpetti
Subpocket Analysis Method for Fragment-Based Drug Discovery.
J. Chem. Inf. Model.
53 (1) (2013)
Gregory A. Landrum
,
Richard Lewis
,
Andrew Palmer
,
Nikolaus Stiefl
,
Anna Vulpetti
Making sure there's a "give" associated with the "take": producing and using open-source software in big pharma.
J. Cheminformatics
3 (S-1) (2011)
Francesca Milletti
,
Anna Vulpetti
Predicting Polypharmacology by Binding Site Similarity: From Kinases to the Protein Universe.
J. Chem. Inf. Model.
50 (8) (2010)
Francesca Milletti
,
Anna Vulpetti
Tautomer Preference in PDB Complexes and its Impact on Structure-Based Drug Discovery.
J. Chem. Inf. Model.
50 (6) (2010)
Anna Vulpetti
,
Patrizia Crivori
,
Alexander Cameron
,
Jay Bertrand
,
Maria Gabriella Brasca
,
Roberto D'Alessio
,
Paolo Pevarello
Structure-Based Approaches to Improve Selectivity: CDK2-GSK3beta Binding Site Analysis.
J. Chem. Inf. Model.
45 (5) (2005)
Romano T. Kroemer
,
Anna Vulpetti
,
Joseph J. McDonald
,
Douglas C. Rohrer
,
Jean-Yves Trosset
,
Fabrizio Giordanetto
,
Simona Cotesta
,
Colin McMartin
,
Mats Kihlén
,
Pieter F. W. Stouten
Assessment of Docking Poses: Interactions-Based Accuracy Classification (IBAC) versus Crystal Structure Deviations.
J. Chem. Inf. Model.
44 (3) (2004)
Fabrizio Giordanetto
,
Simona Cotesta
,
Cornel Catana
,
Jean-Yves Trosset
,
Anna Vulpetti
,
Pieter F. W. Stouten
,
Romano T. Kroemer
Novel Scoring Functions Comprising QXP, SASA, and Protein Side-Chain Entropy Terms.
J. Chem. Inf. Model.
44 (3) (2004)
Laura Belvisi
,
Gianpaolo Bravi
,
Carlo Scolastico
,
Anna Vulpetti
,
Aldo Salimbeni
,
Roberto Todeschini
A 3D QSAR approach to the search for geometrical similarity in a series of nonpeptide angiotensin II receptor antagonists.
J. Comput. Aided Mol. Des.
8 (2) (1994)