Piercarlo Fantucci

发表

Computer generation of symmetry-adapted molecular orbitals

Jaime Fernández Rico, Gianfranco Pacchioni, Piercarlo Fantucci, 1981, Comput. Chem..

Conformational behaviour of the antineoplastic peptide dolastatin-10 and of two mutated derivatives

Nino Russo, Tiziana Marino, Piercarlo Fantucci, 1995, J. Comput. Aided Mol. Des..

Validation of protein models by a neural network approach

Elena Papaleo, Paolo Mereghetti, Piercarlo Fantucci, 2008, BMC Bioinformatics.

-In silico functional characterization of a double histone fold domain from the Heliothis zea virus 1

Piercarlo Fantucci, Claudio Greco, Luca De Gioia, 2005, BMC Bioinformatics.

An Acidic Loop and Cognate Phosphorylation Sites Define a Molecular Switch That Modulates Ubiquitin Charging Activity in Cdc34-Like Enzymes

Elena Papaleo, Lilia Alberghina, Piercarlo Fantucci, 2011, PLoS Comput. Biol..

Introduction to the 1993 como meeting

Piercarlo Fantucci, N. Russo, 1994 .

Conformational behaviour and molecular similarity of some β1-adrenergic ligands

Piercarlo Fantucci, Anna Maria Villa, Elena Mattioli, 1992, J. Comput. Aided Mol. Des..

GPR17: Molecular modeling and dynamics studies of the 3-D structure and purinergic ligand binding features in comparison with P2Y receptors

Piercarlo Fantucci, Chiara Parravicini, Maria P. Abbracchio, 2008, BMC Bioinformatics.

The cold-active lipase of Pseudomonas fragi. Heterologous expression, biochemical characterization and molecular modeling.

Lilia Alberghina, Piercarlo Fantucci, Marina Lotti, 2002, European journal of biochemistry.

Quantum Chemistry of Small Clusters of Elements of Groups Ia, Ib, and IIa: Fundamental Concepts, Predictions, and Interpretation of Experiments

Piercarlo Fantucci, J. Koutecký, V. Bonačić‐Koutecký, 1991 .

Quantum mechanical models of the resting state of the vanadium-dependent haloperoxidase.

Heather A Carlson, Piercarlo Fantucci, C. E. Webster, 2004, Inorganic chemistry.

The yeast cyclin-dependent kinase inhibitor Sic1 and mammalian p27Kip1 are functional homologues with a structurally conserved inhibitory domain.

Matteo Barberis, Lilia Alberghina, Piercarlo Fantucci, 2005, The Biochemical journal.

Density functional study of structural and electronic properties of bimetallic silver–gold clusters: Comparison with pure gold and silver clusters

Jaroslav V. Burda, Piercarlo Fantucci, Maofa Ge, 2002 .

Protein flexibility in psychrophilic and mesophilic trypsins. Evidence of evolutionary conservation of protein dynamics in trypsin‐like serine‐proteases

Elena Papaleo, Piercarlo Fantucci, Laura Riccardi, 2008, FEBS letters.

Structural insights into the active-ready form of [FeFe]-hydrogenase and mechanistic details of its inhibition by carbon monoxide.

Ulf Ryde, Piercarlo Fantucci, Claudio Greco, 2007, Inorganic chemistry.

Direct optimization of orbitals for multiconfiguration self-consistent field theory by unitary transformations: II. Further developments and applications to separated electron pair and to SCF theory

Piercarlo Fantucci, Stefano Polezzo, 1980 .

Free-energy landscape, principal component analysis, and structural clustering to identify representative conformations from molecular dynamics simulations: the myoglobin case.

Elena Papaleo, Paolo Mereghetti, Rita Grandori, 2009, Journal of molecular graphics & modelling.

2-Arylpropionic CXC chemokine receptor 1 (CXCR1) ligands as novel noncompetitive CXCL8 inhibitors.

Giuseppe Nano, Luca Nicolini, Piercarlo Fantucci, 2005, Journal of medicinal chemistry.

Density functional calculations of magnetic exchange interactions in polynuclear transition metal complexes

Vincenzo Barone, Claude Daul, Piercarlo Fantucci, 1997 .

Molecular dynamics investigation of cyclic natriuretic peptides: dynamic properties reflect peptide activity.

Elena Papaleo, Laura Cipolla, Piercarlo Fantucci, 2010, Journal of molecular graphics & modelling.

Recent Advances in Density Functional Methods Part III

Vincenzo Barone, Piercarlo Fantucci, V. Barone, 2002 .

Direct optimization of orbitals for multiconfiguration self-consistent field theory by unitary transformations

Piercarlo Fantucci, Stefano Polezzo, 1980 .

Flexibility and enzymatic cold-adaptation: a comparative molecular dynamics investigation of the elastase family.

Elena Papaleo, Piercarlo Fantucci, Laura Riccardi, 2006, Biochimica et biophysica acta.

Three-dimensional structure of the catalytic domain of the yeast β-(1,3)-glucan transferase Gas1: a molecular modeling investigation

Elena Papaleo, Piercarlo Fantucci, Luca De Gioia, 2006, Journal of molecular modeling.