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Page 1
An automated docking protocol for hERG channel blockers.
J Chem Inf Model. 2013 Jan 28;53(1):159-75. doi: 10.1021/ci300326d. Epub 2013 Jan 9.
J Chem Inf Model. 2013.
PMID: 23259741
Structure-Based Virtual Screening Allows the Identification of Efficient Modulators of E-Cadherin-Mediated Cell-Cell Adhesion.
Dalle Vedove A, Falchi F, Donini S, Dobric A, Germain S, Di Martino GP, Prosdocimi T, Vettraino C, Torretta A, Cavalli A, Rigot V, André F, Parisini E.
Dalle Vedove A, et al. Among authors: di martino gp.
Int J Mol Sci. 2019 Jul 11;20(14):3404. doi: 10.3390/ijms20143404.
Int J Mol Sci. 2019.
PMID: 31373305
Free PMC article.
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Mechanistic insights into Pin1 peptidyl-prolyl cis-trans isomerization from umbrella sampling simulations.
Di Martino GP, Masetti M, Cavalli A, Recanatini M.
Di Martino GP, et al.
Proteins. 2014 Nov;82(11):2943-56. doi: 10.1002/prot.24650. Epub 2014 Aug 11.
Proteins. 2014.
PMID: 25066180
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Multiscale Simulations of a Two-Pore Potassium Channel.
Masetti M, Berti C, Ocello R, Di Martino GP, Recanatini M, Fiegna C, Cavalli A.
Masetti M, et al. Among authors: di martino gp.
J Chem Theory Comput. 2016 Dec 13;12(12):5681-5687. doi: 10.1021/acs.jctc.6b00972. Epub 2016 Nov 18.
J Chem Theory Comput. 2016.
PMID: 27951666
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