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Keybot 114 Results  doktori.bme.hu  Page 10
  Vass Mà¡rton  
11. Hoffer, L., Horvath, D.: S4MPLE - sampler for multiple protein-ligand entities: simultaneous docking of several entities, J. Chem. Inf. Model, 2013, 53, 88
11. Hoffer, L., Horvath, D. S4MPLE - sampler for multiple protein-ligand entities: simultaneous docking of several entities. J. Chem. Inf. Model. 2013, 53, 88.
  Könczöl Là¡szlà³  
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855.
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855. c) S. Grimme, H. Kruse, L. Goerigk, G. Erker, Angew. Chem. 2010, 122, 1444–1447; Angew. Chem. Int. Ed. 2010, 49, 1402–1405.
  Könczöl Là¡szlà³  
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177.
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177. d) P. P. Power, Acc. Chem. Res. 2011, 44, 627–637.
  Könczöl Là¡szlà³  
[7] a) R. H. Crabtree, Angew. Chem. 1993, 105, 828–845; Angew. Chem. Int. Ed. 1993, 32, 789–805. b) G. J. Kubas, in Metal dihydrogen and sigma–bond complexes; Kluwer Academic/Plenum ed. ; New York, 2001.
[7] a) R. H. Crabtree, Angew. Chem. 1993, 105, 828–845; Angew. Chem. Int. Ed. 1993, 32, 789–805. b) G. J. Kubas, in Metal dihydrogen and sigma–bond complexes; Kluwer Academic/Plenum ed.; New York, 2001. c) S. Aldridge, A. J. Downs, Chem. Rev. 2001, 101, 3305–3365. d) G. J. Kubas, Chem. Rev. 2007, 107, 4152–4205. e) R. D. Adams, B. Captain, Angew. Chem. 2008, 120, 258–263; Angew. Chem. Int. Ed. 2008, 47, 252–257. f) G. J. Kubas, J. Organomet. Chem. 2009, 694, 2648–2653.
  Könczöl Là¡szlà³  
[7] a) R. H. Crabtree, Angew. Chem. 1993, 105, 828–845; Angew. Chem. Int. Ed. 1993, 32, 789–805. b) G. J. Kubas, in Metal dihydrogen and sigma–bond complexes; Kluwer Academic/Plenum ed. ; New York, 2001.
[7] a) R. H. Crabtree, Angew. Chem. 1993, 105, 828–845; Angew. Chem. Int. Ed. 1993, 32, 789–805. b) G. J. Kubas, in Metal dihydrogen and sigma–bond complexes; Kluwer Academic/Plenum ed.; New York, 2001. c) S. Aldridge, A. J. Downs, Chem. Rev. 2001, 101, 3305–3365. d) G. J. Kubas, Chem. Rev. 2007, 107, 4152–4205. e) R. D. Adams, B. Captain, Angew. Chem. 2008, 120, 258–263; Angew. Chem. Int. Ed. 2008, 47, 252–257. f) G. J. Kubas, J. Organomet. Chem. 2009, 694, 2648–2653.
  Könczöl Là¡szlà³  
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int.
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int. Ed. 2007, 46, 8050–8053. c) G. C. Welch D. W. Stephan, J. Am. Chem. Soc. 2007, 129, 1880–1881. d) P. Spies, G. Erker, G. Kehr, K. Bergander, R. Fröhlich, S. Grimme, D. W. Stephan, Chem. Commun. 2007, 5072–5074. e) P. Spies, S. Schwendemann, S. Lange, G. Kehr, R. Fröhlich, G. Erker, Angew. Chem. 2008, 120, 7654–7657; Angew. Chem. Int. Ed. 2008, 47, 7543–7546.
  Könczöl Là¡szlà³  
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855.
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855. c) S. Grimme, H. Kruse, L. Goerigk, G. Erker, Angew. Chem. 2010, 122, 1444–1447; Angew. Chem. Int. Ed. 2010, 49, 1402–1405.
  Könczöl Là¡szlà³  
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177.
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177. d) P. P. Power, Acc. Chem. Res. 2011, 44, 627–637.
  Könczöl Là¡szlà³  
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855.
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855. c) S. Grimme, H. Kruse, L. Goerigk, G. Erker, Angew. Chem. 2010, 122, 1444–1447; Angew. Chem. Int. Ed. 2010, 49, 1402–1405.
  Könczöl Là¡szlà³  
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855.
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855. c) S. Grimme, H. Kruse, L. Goerigk, G. Erker, Angew. Chem. 2010, 122, 1444–1447; Angew. Chem. Int. Ed. 2010, 49, 1402–1405.
  Könczöl Là¡szlà³  
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177.
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177. d) P. P. Power, Acc. Chem. Res. 2011, 44, 627–637.
  Könczöl Là¡szlà³  
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177.
[2] a) A. L. Kenward, W. E. Piers, Angew. Chem. 2008, 120, 38–42; Angew. Chem. Int. Ed. 2008, 47, 38–41. b) D. W. Stephan, Chem. Commun. 2010, 46, 8526–8533. c) P. P. Power, Nature 2010, 463, 171–177. d) P. P. Power, Acc. Chem. Res. 2011, 44, 627–637.
  Könczöl Là¡szlà³  
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855.
[9] a) T. A. Rokob, A. Hamza, A. Stirling, T. Soós, I. Papai, Angew. Chem. 2008, 120, 2469–2472; Angew. Chem. Int. Ed. 2008, 47, 2435–2438. b) R. Rajeev, R. B. Sunoj, Chem. Eur. J. 2009, 15, 12846–12855. c) S. Grimme, H. Kruse, L. Goerigk, G. Erker, Angew. Chem. 2010, 122, 1444–1447; Angew. Chem. Int. Ed. 2010, 49, 1402–1405.
  Vass Mà¡rton  
7. Chen, D., Ranganathan, A. et al.: Complementarity between in silico and biophysical screening approaches in fragment-based lead discovery against the A2A adenosine receptor, J. Chem. Inf. Model, 2013, 53, 2701
7. Chen, D., Ranganathan, A. et al. Complementarity between in silico and biophysical screening approaches in fragment-based lead discovery against the A2A adenosine receptor. J. Chem. Inf. Model. 2013, 53, 2701.
  Könczöl Là¡szlà³  
[6] D. W. Stephan, G. Erker, Angew. Chem. 2010, 122, 50–81; Angew. Chem. Int. Ed. 2010, 49, 46–76
[6] D. W. Stephan, G. Erker, Angew. Chem. 2010, 122, 50–81; Angew. Chem. Int. Ed. 2010, 49, 46–76.
  Könczöl Là¡szlà³  
L. Könczöl, E. Makkos, D. Bourissou, D.Szieberth, Angew.Chem Int. Ed. submitted
L. Könczöl, E. Makkos, D. Bourissou, D.Szieberth, Angew.Chem Int. Ed. elküldve
  Könczöl Là¡szlà³  
[11] L. Könczöl, E. Makkos, D. Bourissou, D.Szieberth, Angew.Chem Int. Ed. submitted
[11] L. Könczöl, E. Makkos, D. Bourissou, D.Szieberth, Angew.Chem Int. Ed. elküldve
  Vass Mà¡rton  
T5. Vass, M., Ágai-Csongor, É., Horti, F., Keserű, G. M.: Multiple fragment docking and linking in primary and secondary pockets of dopamine receptors, ACS Med. Chem. Lett. Accepted (IF: 3.311)
T5. Vass, M., Ágai-Csongor, É., Horti, F., Keserű, G.M. Multiple fragment docking and linking in primary and secondary pockets of dopamine receptors. ACS Med. Chem. Lett. Accepted. (IF: 3.311)
  Könczöl Là¡szlà³  
[12] S. Bontemps, G. Bouhadir, P. W. Dyer, K. Miqueu, D. Bourissou, Inorg. Chem. 2007, 46, 5149–5151
[12] S. Bontemps, G. Bouhadir, P. W. Dyer, K. Miqueu, D. Bourissou, Inorg. Chem. 2007, 46, 5149–5151.
  Könczöl Là¡szlà³  
[6] D. W. Stephan, G. Erker, Angew. Chem. 2010, 122, 50–81; Angew. Chem. Int. Ed. 2010, 49, 46–76
[6] D. W. Stephan, G. Erker, Angew. Chem. 2010, 122, 50–81; Angew. Chem. Int. Ed. 2010, 49, 46–76.
  Vass Mà¡rton  
T2. Vass, M., Schmidt, É., Horti, F., Keserű, G. M.: Virtual fragment screening on GPCRs: a case study on dopamine D3 and histamine H4 receptors, Eur. J. Med. Chem., 2014, 77, pp. 38-46 (IF: 3.499)
T2. Vass, M., Schmidt, É., Horti, F., Keserű, G.M. Virtual fragment screening on GPCRs: a case study on dopamine D3 and histamine H4 receptors. Eur. J. Med. Chem. 2014, 77, 38-46. (IF: 3.499)
  Vass Mà¡rton  
12. Nair, P.C., Malde, A. K., Drinkwater, N., Mark, A. E.: Missing fragments: detecting cooperative binding in fragment-based drug design, ACS Med. Chem. Lett., 2012, 3, 322
12. Nair, P.C., Malde, A.K., Drinkwater, N., Mark, A.E. Missing fragments: detecting cooperative binding in fragment-based drug design. ACS Med. Chem. Lett. 2012, 3, 322.
  Vass Mà¡rton  
6. de Graaf, C., Kooistra, A.J. et al.: Crystal structure-based virtual screening for fragment-like ligands of the human histamine H1 receptor, J. Med. Chem. 2011, 54, 8195
6. de Graaf, C., Kooistra, A.J. et al. Crystal structure-based virtual screening for fragment-like ligands of the human histamine H1 receptor. J. Med. Chem. 2011, 54, 8195.
  Vass Mà¡rton  
5. Sándor, M., Kiss, R., Keserű, G. M.: Virtual fragment docking by Glide: a validation study on 190 protein-fragment complexes, J. Chem. Inf. Model. 2010, 50, 1165
5. Sándor, M., Kiss, R., Keserű, G.M. Virtual fragment docking by Glide: a validation study on 190 protein-fragment complexes. J. Chem. Inf. Model. 2010, 50, 1165.
  Könczöl Là¡szlà³  
[4] a) G. D. Frey, V. Lavallo, B. Donnadieu, W. W. Schoeller, G. Bertrand, Science 2007, 316, 439–441. b) D. Martin, M. Soleilhavoup, G. Bertrand, Chem. Sci. 2011, 2, 389–399
[4] a) G. D. Frey, V. Lavallo, B. Donnadieu, W. W. Schoeller, G. Bertrand, Science 2007, 316, 439–441. b) D. Martin, M. Soleilhavoup, G. Bertrand, Chem. Sci. 2011, 2, 389–399.
  Vass Mà¡rton  
Tarcsay, Á. , Paragi, G., Vass, M., Jójárt, B., Bogár, F., Keserű, G. M. : The impact of molecular dynamics sampling on the performance of virtual screening against GPCRs. J. Chem. Inf. Model. , 2013, 53, pp. 2990-2999 (IF: 4.304)
T1. Tarcsay, Á., Paragi, G., Vass, M., Jójárt, B., Bogár, F., Keserű, G.M. The impact of molecular dynamics sampling on the performance of virtual screening against GPCRs. J. Chem. Inf. Model. 2013, 53, 2990-2999. (IF: 4.304)
  Könczöl Là¡szlà³  
[3] a) G. H. Spikes, J. C. Fettinger, P. P. Power, J. Am. Chem. Soc. 2005, 127, 12232–12233. b) Y. Peng, M. Brynda, B. D. Ellis, J. C. Fettinger, E. Rivard, P. P. Power Chem. Commun. 2008, 6042–6044. c) Y. Peng, B. D. Ellis, X. Wang, P. P. Power, J. Am.
[3] a) G. H. Spikes, J. C. Fettinger, P. P. Power, J. Am. Chem. Soc. 2005, 127, 12232–12233. b) Y. Peng, M. Brynda, B. D. Ellis, J. C. Fettinger, E. Rivard, P. P. Power Chem. Commun. 2008, 6042–6044. c) Y. Peng, B. D. Ellis, X. Wang, P. P. Power, J. Am. Chem. Soc. 2008, 130, 12268–12269. d) Y. Peng, J.-D. Guo, B. D. Ellis, Z. Zhu, J. C. Fettinger, S. Nagase, P. P. Power, J. Am. Chem. Soc. 2009, 131, 16272–16282. e) Z. Zhu, X. Wang, Y. Peng, H. Lei, J. C. Fettinger, E. Rivard, P. P. Power, Angew. Chem. 2009, 121, 2065–2068; Angew. Chem. Int. Ed. 2009, 48, 2031–2034.
  Könczöl Là¡szlà³  
[10] a) T. J. Tague Jr., L. Andrews, J. Am. Chem. Soc. 1994, 116, 4970–4976. b) P. R. Schreiner, H. F. Schaefer III, P. v. R. Schleyer, J. Chem. Phys. 1994, 101, 7625–7632. c) J. D. Watts, R. J. Bartlett, J. Am.
[10] a) T. J. Tague Jr., L. Andrews, J. Am. Chem. Soc. 1994, 116, 4970–4976. b) P. R. Schreiner, H. F. Schaefer III, P. v. R. Schleyer, J. Chem. Phys. 1994, 101, 7625–7632. c) J. D. Watts, R. J. Bartlett, J. Am. Chem. Soc. 1995, 117, 825–826. d) S. Fau, G. Frenking, Mol. Phys. 1999, 96, 519–527. e) O. A. Filippov, A. M. Filin, V. N. Tsupreva, N. V. Belkova, A. Lledós, G. Ujaque, L. M. Epstein, E. S. Shubina, Inorg. Chem. 2006, 45, 3086–3096. f) C. Fan, L. G. Mercier, W. E. Piers, H. M. Tuononen, M. Parvez, J. Am. Chem. Soc. 2010, 132, 9604–9606. g) Z. Lu, Z. Cheng, Z. Chen, L. Weng, Z. H. Li, H. Wang, Angew. Chem. 2011, 123, 12435–12439; Angew. Chem. Int. Ed. 2011, 50, 12227–12231. h) G. I. Nikonov, S. F. Vyboishchikov, O. G. Shirobokov, J. Am. Chem. Soc. 2012, 134, 5488–5491. d) J.-L. M. Abboud, B. Németh, J.-C. Guillemin, P.Burk, A. Adamson, E. R. Nerut, Chem. Eur. J. 2012, 18, 3981–3991.
  Vass Mà¡rton  
Multiple fragment docking was investigated by only a few groups [11] but the fact that the paper on D3 fragment linking [T5] was accepted in ACS Med Chem Letters also showed the interest towards the applications.
A GPCR dúsulási tesztekről szóló publikációnk [T1] a 3. helyet érte el a JCIM legolvasottabb cikkei között, a prospektív GPCR fragmens szűrésről szóló cikket [T2] pedig a megjelenés utáni hónapban majdnem 500-an töltötték le, ami mutatja a cikkek iránti érdeklődést. Több fragmens dokkolásával kevesen foglalkoztak eddig [11], de a D3 fragmens kapcsolásról szóló cikk [T5] ACS Med Chem Lettersben való megjelenése szintén jelzi az alkalmazások iránti érdeklődést.
  Könczöl Là¡szlà³  
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int.
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int. Ed. 2007, 46, 8050–8053. c) G. C. Welch D. W. Stephan, J. Am. Chem. Soc. 2007, 129, 1880–1881. d) P. Spies, G. Erker, G. Kehr, K. Bergander, R. Fröhlich, S. Grimme, D. W. Stephan, Chem. Commun. 2007, 5072–5074. e) P. Spies, S. Schwendemann, S. Lange, G. Kehr, R. Fröhlich, G. Erker, Angew. Chem. 2008, 120, 7654–7657; Angew. Chem. Int. Ed. 2008, 47, 7543–7546.
  Könczöl Là¡szlà³  
[7] a) R. H. Crabtree, Angew. Chem. 1993, 105, 828–845; Angew. Chem. Int. Ed. 1993, 32, 789–805. b) G. J. Kubas, in Metal dihydrogen and sigma–bond complexes; Kluwer Academic/Plenum ed. ; New York, 2001.
[7] a) R. H. Crabtree, Angew. Chem. 1993, 105, 828–845; Angew. Chem. Int. Ed. 1993, 32, 789–805. b) G. J. Kubas, in Metal dihydrogen and sigma–bond complexes; Kluwer Academic/Plenum ed.; New York, 2001. c) S. Aldridge, A. J. Downs, Chem. Rev. 2001, 101, 3305–3365. d) G. J. Kubas, Chem. Rev. 2007, 107, 4152–4205. e) R. D. Adams, B. Captain, Angew. Chem. 2008, 120, 258–263; Angew. Chem. Int. Ed. 2008, 47, 252–257. f) G. J. Kubas, J. Organomet. Chem. 2009, 694, 2648–2653.
  Könczöl Là¡szlà³  
[3] a) G. H. Spikes, J. C. Fettinger, P. P. Power, J. Am. Chem. Soc. 2005, 127, 12232–12233. b) Y. Peng, M. Brynda, B. D. Ellis, J. C. Fettinger, E. Rivard, P. P. Power Chem. Commun. 2008, 6042–6044. c) Y. Peng, B. D. Ellis, X. Wang, P. P. Power, J. Am.
[3] a) G. H. Spikes, J. C. Fettinger, P. P. Power, J. Am. Chem. Soc. 2005, 127, 12232–12233. b) Y. Peng, M. Brynda, B. D. Ellis, J. C. Fettinger, E. Rivard, P. P. Power Chem. Commun. 2008, 6042–6044. c) Y. Peng, B. D. Ellis, X. Wang, P. P. Power, J. Am. Chem. Soc. 2008, 130, 12268–12269. d) Y. Peng, J.-D. Guo, B. D. Ellis, Z. Zhu, J. C. Fettinger, S. Nagase, P. P. Power, J. Am. Chem. Soc. 2009, 131, 16272–16282. e) Z. Zhu, X. Wang, Y. Peng, H. Lei, J. C. Fettinger, E. Rivard, P. P. Power, Angew. Chem. 2009, 121, 2065–2068; Angew. Chem. Int. Ed. 2009, 48, 2031–2034.
  Könczöl Là¡szlà³  
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int.
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int. Ed. 2007, 46, 8050–8053. c) G. C. Welch D. W. Stephan, J. Am. Chem. Soc. 2007, 129, 1880–1881. d) P. Spies, G. Erker, G. Kehr, K. Bergander, R. Fröhlich, S. Grimme, D. W. Stephan, Chem. Commun. 2007, 5072–5074. e) P. Spies, S. Schwendemann, S. Lange, G. Kehr, R. Fröhlich, G. Erker, Angew. Chem. 2008, 120, 7654–7657; Angew. Chem. Int. Ed. 2008, 47, 7543–7546.
  Könczöl Là¡szlà³  
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int.
[5] a) G. C. Welch, R. R. San Juan, J. D. Masuda, D. W. Stephan, Science 2006, 314, 1124–1126. b) P. A. Chase, G. C. Welch, T. Jurca, D. W. Stephan, Angew. Chem. 2007, 119, 8196–8199; Angew. Chem. Int. Ed. 2007, 46, 8050–8053. c) G. C. Welch D. W. Stephan, J. Am. Chem. Soc. 2007, 129, 1880–1881. d) P. Spies, G. Erker, G. Kehr, K. Bergander, R. Fröhlich, S. Grimme, D. W. Stephan, Chem. Commun. 2007, 5072–5074. e) P. Spies, S. Schwendemann, S. Lange, G. Kehr, R. Fröhlich, G. Erker, Angew. Chem. 2008, 120, 7654–7657; Angew. Chem. Int. Ed. 2008, 47, 7543–7546.
  Könczöl Là¡szlà³  
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  Könczöl Là¡szlà³  
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  Könczöl Là¡szlà³  
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  Könczöl Là¡szlà³  
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  Könczöl Là¡szlà³  
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[O8] Mezei, P. D.; Ruzsinszky, A.; Csonka, G. I. J. Chem. Theory Comput. 2016,
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[O7] Mezei, P. D.; Csonka, G. I. Struct. Chem. 2016, STUC-D-16-00037R1 (accepted).
[S7] Mezei, P. D.; Csonka, G. I. Struct. Chem. 2016, STUC-D-16-00037R1 (elfogadva).
  MEZEI Pà¡l Dà¡niel  
[O3] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A. J. Chem. Theory Comput. 2015, 11,
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Chem. Eng. 2016, 60, 2–7. (IF = 0.296, CT =2)
Chem. Eng. 2016, 60, 2-7. (IF = 0,296, ID =2)
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[O2] Mezei, P. D.; Csonka, G. I.; Kállay, M. J. Chem. Theory Comput. 2015, 11, 2879–2888.
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[O6] Mezei, P. D.; Csonka, G. I. Struct. Chem. 2015, 26, 1367–1379. (IF = 1.837)
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J Med Chem. 2013, 56, pp. 1789-1795. (IF: 5.248)
J Med Chem. 2013, 56, 1789-1795. old. (IF: 5.248)
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[O4] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A.; Kállay, M. J. Chem. Theory Comput.
[S4] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A.; Kállay, M. J. Chem. Theory Comput.
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[O1] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A.; Sun, J. J. Chem. Theory Comput. 2015,
[S1] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A.; Sun, J. J. Chem. Theory Comput. 2015,
  Gyarmati Benjà¡min  
[GY8] Gyarmati B, Szilágyi A. Preface for papers presented at AMSALS 2012. Period. Polytech. Chem. Eng. 2013; 58(1):47-48. (IF 2012: 0.269, IC:0)
[GY8] Gyarmati B, Szilágyi A. Preface for papers presented at AMSALS 2012. Period. Polytech. Chem. Eng. 2013; 58(1):47-48. (IF 2012: 0,269, IC:0)
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[T4] Tarcsay, A.; Keserű, G.M., Homology modelling and binding site assessment of the human P-glycoprotein. Future Med Chem. 2011, 3,pp. 297-307. (IF:2.522)
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  Mezei Pà¡l Dà¡niel  
[O3] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A. J. Chem. Theory Comput. 2015 just accepted, published online. ct–2015–00269g
[S3] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A. J. Chem. Theory Comput. 2015 most elfogadott, online közzétéve. ct–2015–00269g
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[O4] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A.; Kállay, M. J. Chem. Theory Comput. 2015 under revision. ct–2015–00420z
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  Kiss Nà³ra Zsuzsa  
[K9] G. Keglevich, N. Zs. Kiss, T. Körtvélyesi, Heteroatom Chem. 2013, in press
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[K8] G. Keglevich, A. Grün, E. Bálint, N. Zs. Kiss, E. Jablonkai, Curr. Org. Chem. 2013, 17, pp. 545-554.
[K9] Keglevich, G.; Kiss, N. Zs.; Körtvélyesi, T., Heteroatom Chem. 2013, nyomdában
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[K12] N. Zs. Kiss. É. V. Böttger, L. Drahos, G. Keglevich, Heteroatom Chem, 2013, 24, 283-288. page
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  Boros Zoltà¡n  
[B] E. Abaháziová, Z. Boros, P. Kovács, L. Poppe: Surface modification of silica gels for selective adsorption of bacterial lipases, Stud. Univ. Babes-Bolyai, Chem, 2012, accepted for publication
[A] M. Oláh, Z. Boros, P. Sátorhelyi, V. Bódai, E. Balázs, L. Poppe: Kinetic resolution of racemic 1-phenylethanamine catalyzed by lipase B from Candida antarctica – Effect of the acylating agent and the mode of enzyme immobilization, Stud. Univ. Babes-Bolyai, Chem, 2012, közlésre elfogadva
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[K7] G. Keglevich, N. Zs. Kiss, Z. Mucsi, T. Körtvélyesi, Org. Biomol. Chem. 2012, 10, pp. 2011-2018.
[K8] Keglevich, G.; Grün, A.; Bálint, E.; Kiss, N. Zs.; Jablonkai, E., Curr. Org. Chem. 2013, 17, 545-554. old.
  Kiss Nà³ra Zsuzsa  
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[6] C. O. Kappe., Angew. Chem. Int. Ed., 2004, 43, 6250-628
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[4] C. O. Kappe, B. Pieber, D. Dallinger, Angew. Chem. 2013, 52, 1088.
[4] C. O. Kappe, B. Pieber, D. Dallinger., Angew. Chem. 2013, 52, 1088.
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[O1] Mezei, P. D.; Csonka, G. I.; Ruzsinszky, A.; Sun, J. J. Chem. Theory Comput. 2015, 11, 360–371.
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  Kiss Nà³ra Zsuzsa  
[K5] G. Keglevich, N. Zs. Kiss, G.K. Menyhárd, A. Fehérvári, I. Csontos, Heteroatom Chem 2012, 23, pp. 171-178.
[K6] Kiss, N. Zs.; Kaszás A.; Drahos, L.; Mucsi, Z.; Keglevich, G., Tetrahedron Lett. 2012, 53, 207–209. old.
  Kiss Nà³ra Zsuzsa  
[K2] G. Keglevich, E. Bálint, N. Zs. Kiss, E. Jablonkai, L. Hegedűs, A. Grün, I. Greiner, Curr Org Chem 2011, 15, pp. 1802-1810.
[K3] Keglevich, G.; Kiss, N. Zs.; Balint E.; Jablonkai E.; Grün A.; Milen M.; Frigyes D.; Greiner I., Phosphorus, Sulfur, 2011, 186, 802-803. old.
  Boros Zoltà¡n  
[G] Z. Boros, M. Szigeti, A. Tomin, P. Kovács, L. Ürge, F. Darvas, L. Poppe: Asymmetric biotransformations in continuous flow reactors, Stud. Univ. Babes-Bolyai, Chem, 2009, 54, 69-75.
[F] J. Brem, M. Naghi, M. Tosa, Z. Boros, L. Poppe, F. Irimie, C. Paizs: Lipase mediated sequential resolution of aromatic β-hydroxy esters using fatty acid derivatives, Tetrahedron: Asymmetry, 2011, 22, 1672-1679.
  Mà¡rkus Bence Gà¡bor  
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  Vigh Tamà¡s  
[2] S. Ferguson, G. Morris, H. Hao, M. Barrett, B. Glennon: Characterization of the anti-solvent batch, plug flow and MSMPR crystallization of benzoic acid, Chem. Eng. Sci. 104 (2013) pp. 44-54
[2] S. Ferguson, G. Morris, H. Hao, M. Barrett, B. Glennon, Characterization of the anti-solvent batch, plug flow and MSMPR crystallization of benzoic acid, Chem. Eng. Sci. 104 (2013) 44–54.
  Boros Zoltà¡n  
[E] P. Falus, Z. Boros, G. Hornyánszky, J. Nagy, L. Ürge, F. Darvas. L. Poppe: Synthesis and lipase catalysed kinetic resolution of racemic amines, Stud. Univ. Babes-Bolyai, Chem, 2010, 55, 289-296.
[D] G. Hellner, Z. Boros, A. Tomin, L. Poppe: Novel sol-gel lipases by designed bioimprinting for continuous-flow kinetic resolutions, Advanced Synthesis & Catalysis, 2011, 353, 2481-2491.
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