Molecular dynamics: New advances in drug discovery (433 views)
Eur J Med Chem (ISSN: 0223-5234, 1768-3254, 0223-5234linking), 2015; 91: 1-3.
Export to BibTeX Export to EndNote
Paper type: Journal Article,
Impact factor: 3.902, 5-year impact factor: 3.982
Url: http://www.scopus.com/inward/record.url?eid=2-s2.0-84921445214&partnerID=40&md5=9151ff22645203678d09196ee562f6f6
Keywords: Aciclovir, Amyloid, Antivirus Agent, Guanine Nucleotide Binding Protein, Phosphotransferase Inhibitor, Proteinase Inhibitor, Agrobacterium Tumefaciens, Alzheimer Disease, Dna Binding, Drug Design, Drug Development, Human, Medicinal Chemistry, Metabolism, Molecular Dynamics, Nonhuman, Nuclear Magnetic Resonance, Prion Disease, Protein Folding, Protein Interaction, Quantum Mechanics, Review, Smallpox Virus, X Ray, X Ray Crystallography,
Affiliations:
*** IBB - CNR ***
National Research Council, Institute of Biostructures and Bioimages, Via Paolo Gaifami 18, Catania, Italy
University of Catania, Dipartimento di Scienze Chimiche, Viale Andrea Doria, 6, Catania, Italy
References:
Hoffmann, T., Metternich, R., The future of medicinal chemistry (2012) Angew. Chem. Int. Ed., 51, pp. 8670-867
Klebe, G., Virtual ligand screening: Strategies, perspectives and limitations (2006) Drug Discov. Today, 11, pp. 580-594
Mauser, H., Guba, W., Recent developments in de novo design and scaffold hopping (2008) Curr. Opin. Drug Discov. Devel., 11, pp. 365-374
Koppen, H., Virtual screening-what does it give us? (2009) Curr. Opin. Drug Discov. Devel., 12, pp. 397-407
Song, C.M., Lim, S.J., Tong, J.C., Recent advances in computer-aided drug design (2009) Brief. Bioinform., 10, pp. 579-591
Jorgensen, W.L., Efficient drug lead discovery and optimization (2009) Accounts Chem. Res., 42, pp. 724-733
Schneider, G., Clement-Chomienne, O., Hilfiger, L., Schneider, P., Kirsch, S., Bohm, H.J., Neidhart, W., Virtual screening for bioactive molecules by evolutionary de novo design (2000) Angew. Chem. Int. Ed., 39, pp. 4130-4133
Alvarez, J., Shoichet, B., (2005) Virtual Screening in Drug Discovery, , Taylor & Francis Boca Raton
McInnes, C., Virtual screening strategies in drug discovery (2007) Curr. Opin. Chem. Biol., 11, pp. 494-502
Totrov, M., Abagyan, R., Flexible ligand docking to multiple receptor conformations: A practical alternative (2008) Curr. Opin. Struct. Biol., 18, pp. 178-184
Sotriffer, C.A., Sanschagrin, P., Matter, H., Klebe, G., SFCscore: Scoring functions for affinity prediction of protein-ligand complexes (2008) Proteins, 73, pp. 395-419
Subramanian, J., Sharma, S.D., Managing protein flexibility in docking and its applications (2009) Drug Discov. Today, 14, pp. 394-400
Adcock, S.A., McCammon, J.A., Molecular dynamics: Survey of methods for simulating the activity of proteins (2006) Chem. Rev., 106, pp. 1589-1615
Eur J Med Chem (ISSN: 0223-5234, 1768-3254, 0223-5234linking), 2015; 91: 1-3.
Export to BibTeX Export to EndNote
Paper type: Journal Article,
Impact factor: 3.902, 5-year impact factor: 3.982
Url: http://www.scopus.com/inward/record.url?eid=2-s2.0-84921445214&partnerID=40&md5=9151ff22645203678d09196ee562f6f6
Keywords: Aciclovir, Amyloid, Antivirus Agent, Guanine Nucleotide Binding Protein, Phosphotransferase Inhibitor, Proteinase Inhibitor, Agrobacterium Tumefaciens, Alzheimer Disease, Dna Binding, Drug Design, Drug Development, Human, Medicinal Chemistry, Metabolism, Molecular Dynamics, Nonhuman, Nuclear Magnetic Resonance, Prion Disease, Protein Folding, Protein Interaction, Quantum Mechanics, Review, Smallpox Virus, X Ray, X Ray Crystallography,
Affiliations:
*** IBB - CNR ***
National Research Council, Institute of Biostructures and Bioimages, Via Paolo Gaifami 18, Catania, Italy
University of Catania, Dipartimento di Scienze Chimiche, Viale Andrea Doria, 6, Catania, Italy
References:
Hoffmann, T., Metternich, R., The future of medicinal chemistry (2012) Angew. Chem. Int. Ed., 51, pp. 8670-867
Klebe, G., Virtual ligand screening: Strategies, perspectives and limitations (2006) Drug Discov. Today, 11, pp. 580-594
Mauser, H., Guba, W., Recent developments in de novo design and scaffold hopping (2008) Curr. Opin. Drug Discov. Devel., 11, pp. 365-374
Koppen, H., Virtual screening-what does it give us? (2009) Curr. Opin. Drug Discov. Devel., 12, pp. 397-407
Song, C.M., Lim, S.J., Tong, J.C., Recent advances in computer-aided drug design (2009) Brief. Bioinform., 10, pp. 579-591
Jorgensen, W.L., Efficient drug lead discovery and optimization (2009) Accounts Chem. Res., 42, pp. 724-733
Schneider, G., Clement-Chomienne, O., Hilfiger, L., Schneider, P., Kirsch, S., Bohm, H.J., Neidhart, W., Virtual screening for bioactive molecules by evolutionary de novo design (2000) Angew. Chem. Int. Ed., 39, pp. 4130-4133
Alvarez, J., Shoichet, B., (2005) Virtual Screening in Drug Discovery, , Taylor & Francis Boca Raton
McInnes, C., Virtual screening strategies in drug discovery (2007) Curr. Opin. Chem. Biol., 11, pp. 494-502
Totrov, M., Abagyan, R., Flexible ligand docking to multiple receptor conformations: A practical alternative (2008) Curr. Opin. Struct. Biol., 18, pp. 178-184
Sotriffer, C.A., Sanschagrin, P., Matter, H., Klebe, G., SFCscore: Scoring functions for affinity prediction of protein-ligand complexes (2008) Proteins, 73, pp. 395-419
Subramanian, J., Sharma, S.D., Managing protein flexibility in docking and its applications (2009) Drug Discov. Today, 14, pp. 394-400
Adcock, S.A., McCammon, J.A., Molecular dynamics: Survey of methods for simulating the activity of proteins (2006) Chem. Rev., 106, pp. 1589-1615
Molecular dynamics: New advances in drug discovery
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Molecular dynamics: New advances in drug discovery
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Molecular dynamics: New advances in drug discovery
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Impact Factor: 4.011
View Export to BibTeX Export to EndNote
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Impact Factor: 5.158
View Export to BibTeX Export to EndNote
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* Towards understanding the molecular recognition process in prokaryotic zinc-finger domain (485 views)
Eur J Med Chem (ISSN: 0223-5234, 1768-3254, 0223-5234linking), 2015; 91: 100-108.
Impact Factor: 3.902
View Export to BibTeX Export to EndNote
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Impact Factor: 3.337
View Export to BibTeX Export to EndNote
Romanucci V, Milardi D, Campagna T, Gaglione M, Messere A, D'Urso A, Crisafi E, La Rosa C, Zarrelli A, Balzarini J, Di Fabio G
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Impact Factor: 2.793
View Export to BibTeX Export to EndNote
Palmieri M, Russo L, Malgieri G, Esposito S, Baglivo I, Rivellino A, Farina B, de Paola I, Zaccaro L, Milardi D, Isernia C, Pedone PV, Fattorusso R
* Deciphering the zinc coordination properties of the prokaryotic zinc finger domain: The solution structure characterization of Ros87 H42A functional mutant (408 views)
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Impact Factor: 3.444
View Export to BibTeX Export to EndNote
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Metallomics (ISSN: 1756-591x, 1756-5901, 1756-591xelectronic), 2013 Dec 18; 6(1): 96-104.
Impact Factor: 3.978
View Export to BibTeX Export to EndNote
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Impact Factor: 19.358
View Export to BibTeX Export to EndNote
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View Export to BibTeX Export to EndNote
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Impact Factor: 1.862
View Export to BibTeX Export to EndNote
Palmieri G, Bergamo P, Luini A, Ruvo M, Gogliettino M, Langella E, Saviano M, Hegde RN, Sandomenico A, Rossi M
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Impact Factor: 4.092
View Export to BibTeX Export to EndNote
Galdiero S, Falanga A, Vitiello M, Cantisani M, Marra V, Galdiero M
* Silver Nanoparticles as Potential Antiviral Agents (769 views)
Molecules (ISSN: 1420-3049, 1420-3049electronic, 1420-3049linking), 2011 Oct; 16(10): 8894-8918.
Impact Factor: 2.386
View Export to BibTeX Export to EndNote
Cuocolo A
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Q J Nucl Med Mol Im (ISSN: 1824-4785, 1824-4478, 1824-4785linking), 2011 Jun; 55(3): 280-300.
Impact Factor: 1.724
View Export to BibTeX Export to EndNote
Perrone-filardi P, Dellegrottaglie S, Rudd JH, Costanzo P, Marciano C, Vassallo E, Marsico F, Ruggiero D, Petretta MP, Chiariello M, Cuocolo A
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Eur J Nucl Med (ISSN: 1619-7089, 1619-7070, 0340-6997), 2011 May; 38(5): 969-975.
Impact Factor: 4.991
View Export to BibTeX Export to EndNote
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Impact Factor: 5.712
View Export to BibTeX Export to EndNote
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Impact Factor: 3.825
View Export to BibTeX Export to EndNote
Palmieri G, Catara G, Saviano M, Langella E, Gogliettino M, Rossi M
* First archaeal PEPB-serine protease inhibitor from sulfolobus solfataricus with noncanonical amino acid sequence in the reactive-site loop (399 views)
J Proteome Res (ISSN: 1535-3893), 2009 Jan; 8(1): 327-334.
Impact Factor: 5.132
View Export to BibTeX Export to EndNote
Gioia M, Monaco S, Van Den Steen PE, Sbardella D, Grasso G, Marini S, Overall CM, Opdenakker G, Coletta M
* The Collagen Binding Domain of Gelatinase A Modulates Degradation of Collagen IV by Gelatinase (460 views)
J Mol Biol (ISSN: 0022-2836, 1089-8638, 1089-8638electronic), 2009; 386(2): 419-434.
Impact Factor: 3.871
View Export to BibTeX Export to EndNote
Marasco D, Perretta G, Sabatella M, Ruvo M
* Past and Future Perspectives of Synthetic Peptide Libraries (562 views)
Curr Protein Pept Sci (ISSN: 1389-2037, 1389-2037linking), 2008 Oct; 9(5): 447-467.
Impact Factor: 3.011
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Malgieri G, Russo L, Esposito S, Baglivo I, Zaccaro L, Pedone EM, Di Blasio B, Isernia C, Pedone PV, Fattorusso R
* The Prokaryotic Cys2his2 Zinc Finger Domain Adopts A Novel Fold As Revealed By The Solution Structure Of Agrobacterium Tumefaciens Ros Dna Binding Domain (480 views)
P Natl Acad Sci Usa (ISSN: 0027-8424, 1091-6490, 0027-8424print), 2007 Oct 30; 104(44): 17341-17346.
Impact Factor: 9.598
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Tarantino G, Gentile A, Capone D, Basile V, Tarantino M, Di Minno MN, Cuocolo A, Conca P
* Does protracted antiviral therapy impact on HCV-related liver cirrhosis progression? (312 views)
World J Gastroentero (ISSN: 1007-9327, 2219-2840, 1007-9327linking), 2007 Sep 28; 13(36): 4903-4908.
Impact Factor: 2.433
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Grasso G, Fragai M, Rizzarelli E, Spoto G, Yeo KJ
* A new methodology for monitoring the activity of cdMMP-12 anchored and freeze-dried on Au (111) (359 views)
Journal Of The American Society For Mass Spectrometry (ISSN: 1044-0305), 2007 May; 18(5): 961-969.
Impact Factor: 3.664
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Dalla Bona A, Formaggio F, Peggion C, Kaptein B, Broxterman Quirinus B, Galdiero S, Galdiero M, Vitiello M, Benedetti E, Toniolo C
* Synthesis, conformation, and bioactivity of novel analogues of the antiviral lipopeptide halovir (501 views)
J Pept Sci (ISSN: 1075-2617, 1099-1387, 1075-2617print), 2006 Dec; 12(12): 748-757.
Impact Factor: 1.801
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Esposito S, Baglivo I, Malgieri G, Russo L, Zaccaro L, D'Andrea LD, Mammucari M, Di Blasio B, Isernia C, Fattorusso R, Pedone PV
* A novel type of zinc finger DNA binding domain in the Agrobacterium tumefaciens transcriptional regulator Ros (739 views)
Biochemistry (ISSN: 0006-2960, 1520-4995, 1520-4995electronic), 2006 Sep 29; 45(34): 10394-10405.
Impact Factor: 3.633
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Grasso G, D'Agata R, Rizzarelli E, Spoto G, D'Andrea LD, Pedone C, Picardi A, Romanelli A, Fragai M, Yeo KJ
* Activity of anchored human matrix metalloproteinase-1 catalytic domain on Au(111) surfaces monitored by ESI-MS (577 views)
J Mass Spectrom (ISSN: 1076-5174, 1096-9888), 2005 Dec; 40(12): 1565-1571.
Impact Factor: 3.574
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Iaccarino G, Ciccarelli M, Sorriento D, Galasso G, Campanile A, Santulli G, Cipolletta E, Cerullo V, Cimini V, Altobelli GG, Piscione F, Priante O, Pastore L, Chiariello M, Salvatore F, Koch WJ, Trimarco B
* Ischemic neoangiogenesis enhanced by β2-adrenergic receptor overexpression: A novel role for the endothelial adrenergic system (395 views)
Circ Res (ISSN: 0009-7330, 1524-4571electronic), 2005; 97(11): 1182-1189.
Impact Factor: 9.408
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De Simone G, Menchise V, Omaggio S, Pedone C, Scozzafava A, Supuran CT
* Design of weakly basic thrombin inhibitors incorporating novel P1 binding functions: Molecular and X-ray crystallographic studies (354 views)
Biochemistry (ISSN: 0006-2960, 1520-4995, 1520-4995electronic), 2003 Sep 5; 42(30): 9013-9021.
Impact Factor: 3.922
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Spalletti-cernia D, Sorrentino R, Di Gaetano S, Arciello A, Garbi C, Piccoli R, D'Alessio G, Vecchio G, Laccetti P, Santoro M
* Antineoplastic ribonucleases selectively kill thyroid carcinoma cells via caspase-mediated induction of apoptosis (393 views)
Journal Of Clinical Endocrinology & Metabolism (ISSN: 0021-972x), 2003 Jun; 88(6): 2900-2907.
Impact Factor: 5.873
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De Falco S, Ruvoletto MG, Verdoliva A, Ruvo M, Raucci A, Marino M, Senatore S, Cassani G, Alberti A, Pontisso P, Fassina G
* Cloning and Expression of a Novel Hepatitis B Virus-binding Protein from HepG2 Cells (628 views)
Jbc Papers (ISSN: 0021-9258, 1083-351x, 0021-9258linking), 2001 Sep 28; 276(39): 36613-36623.
Impact Factor: 7.258
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Lombardi A, De Simone G, Galdiero S, Staiano N, Nastri F, Pavone V
From natural to synthetic multisite thrombin inhibitors (349 views)
Biopolymers (ISSN: 0006-3525, 0006-6352, 0006-3525print), 1999; 51(1): 19-39.
Impact Factor: 2.331
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Pavone V, De Simone G, Nastri F, Galdiero S, Staiano N, Lombardi A, Pedone C
Multiple binding mode of reversible synthetic thrombin inhibitors. A comparative structural analysis (591 views)
Biol Chem Biological Chemistry (ISSN: 1431-6730, 1437-4315), 1998 Sep; 379(8-9): 987-1006.
Impact Factor: 2.636
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31 Records (31 excluding Abstracts).
Total impact factor: 140.993 (140.993 excluding Abstracts).
Total 5 year impact factor: 143.4 (143.4 excluding Abstracts).
Total impact factor: 140.993 (140.993 excluding Abstracts).
Total 5 year impact factor: 143.4 (143.4 excluding Abstracts).
433 views. Last view on Friday 19 May 2023, 15:47:09
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