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Combination of 2D/3D ligand-based similarity search in rapid virtual screening from multimillion compound repositories. Selection and biological evaluation of potential PDE4 and PDE5 inhibitors.
Dobi K, Hajdú I, Flachner B, Fabó G, Szaszkó M, Bognár M, Magyar C, Simon I, Szisz D, Lőrincz Z, Cseh S, Dormán G. Dobi K, et al. Among authors: simon i. Molecules. 2014 May 28;19(6):7008-39. doi: 10.3390/molecules19067008. Molecules. 2014. PMID: 24879613 Free PMC article.
SCide: identification of stabilization centers in proteins.
Dosztányi Z, Magyar C, Tusnády G, Simon I. Dosztányi Z, et al. Among authors: simon i. Bioinformatics. 2003 May 1;19(7):899-900. doi: 10.1093/bioinformatics/btg110. Bioinformatics. 2003. PMID: 12724305
Servers for sequence-structure relationship analysis and prediction.
Dosztányi Z, Magyar C, Tusnády GE, Cserzo M, Fiser A, Simon I. Dosztányi Z, et al. Among authors: simon i. Nucleic Acids Res. 2003 Jul 1;31(13):3359-63. doi: 10.1093/nar/gkg589. Nucleic Acids Res. 2003. PMID: 12824327 Free PMC article.
SRide: a server for identifying stabilizing residues in proteins.
Magyar C, Gromiha MM, Pujadas G, Tusnády GE, Simon I. Magyar C, et al. Among authors: simon i. Nucleic Acids Res. 2005 Jul 1;33(Web Server issue):W303-5. doi: 10.1093/nar/gki409. Nucleic Acids Res. 2005. PMID: 15980477 Free PMC article.
Gromiha, G. Pujadas, C. Magyar, S. Selvaraj, and I. Simon (2004), Proteins, 55, 316-329] and is now generalized for all proteins of known 3D structure. ...
Gromiha, G. Pujadas, C. Magyar, S. Selvaraj, and I. Simon (2004), Proteins, 55, 316-329] and is now generalized for all protei …
Combination of Pharmacophore Matching, 2D Similarity Search, and In Vitro Biological Assays in the Selection of Potential 5-HT6 Antagonists from Large Commercial Repositories.
Dobi K, Flachner B, Pukáncsik M, Máthé E, Bognár M, Szaszkó M, Magyar C, Hajdú I, Lőrincz Z, Simon I, Fülöp F, Cseh S, Dormán G. Dobi K, et al. Among authors: simon i. Chem Biol Drug Des. 2015 Oct;86(4):864-80. doi: 10.1111/cbdd.12563. Epub 2015 Apr 30. Chem Biol Drug Des. 2015. PMID: 25823681
633 results