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Luigi Cavallo
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2020 – today
- 2023
- [j9]Yury Minenkov
, Luigi Cavallo
Influence of the complete basis set approximation, tight weighted-core, and diffuse functions on the DLPNO-CCSD(T1) atomization energies of neutral H,C,O-compounds. J. Comput. Chem. 44(5): 687-696 (2023) - 2020
- [j8]Didier Barradas-Bautista
The CASP13-CAPRI targets as case studies to illustrate a novel scoring pipeline integrating CONSRANK with clustering and interface analyses. BMC Bioinform. 21-S(8): 262 (2020)
2010 – 2019
- 2015
- [j7]Edrisse Chermak, Andrea Petta, Luigi Serra, Anna Vangone
CONSRANK: a server for the analysis, comparison and ranking of docking models based on inter-residue contacts. Bioinform. 31(9): 1481-1483 (2015) - 2014
- [j6]Safwat Abdel-Azeim
MDcons: Intermolecular contact maps as a tool to analyze the interface of protein complexes from molecular dynamics trajectories. BMC Bioinform. 15(S-5): S1 (2014) - 2013
- [c2]Albert Poater
Steric Maps to Evaluate the Role of Steric Hindrance On the IPr NHC Ligand. ICCS 2013: 845-854 - 2012
- [j5]Anna Vangone
CONS-COCOMAPS: a novel tool to measure and visualize the conservation of inter-residue contacts in multiple docking solutions. BMC Bioinform. 13(S-4): S19 (2012) - 2011
- [j4]Anna Vangone
COCOMAPS: a web application to analyze and visualize contacts at the interface of biomolecular complexes. Bioinform. 27(20): 2915-2916 (2011) - [c1]Albert Poater
Deactivation of Ru-benzylidene Grubbs catalysts active in olefin metathesis. ICCS 2011: 1222-1229
2000 – 2009
- 2009
- [j3]Albert Poater
Modeling the structure-property relationships of nanoneedles: A journey toward nanomedicine. J. Comput. Chem. 30(2): 275-284 (2009) - 2003
- [j2]Luigi Cavallo
POPS: a fast algorithm for solvent accessible surface areas at atomic and residue level. Nucleic Acids Res. 31(13): 3364-3366 (2003) - 2002
- [j1]Franca Fraternali
Parameter optimized surfaces (POPS): analysis of key interactions and conformational changes in the ribosome. Nucleic Acids Res. 30(13): 2950-2960 (2002)
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