Mikołaj Feliks, M.Sc.

A3/314
(+48 71) 320 28 94
feliks@mml.ch.pwr.wroc.pl
http://mml.ch.pwr.wroc.pl/~feliks

Research profile

Modeling of asymmetric organocatalysis and enzymatic catalysis

Publications

  1. M. Chojnacka, M. Feliks, W. Beker, W. A. Sokalski, Predicting substituent effects on activation energy changes by static catalytic fields, J.Mol.Model. 24 (1), 28 (2018) DOI
  2. W. Beker, K. M. Langner, E. Dyguda-Kazimierowicz, M. Feliks, W. A. Sokalski, Low cost prediction of relative stabilities of hydrogen bonded complexes from atomic multipole moments for overly short intermolecular distances, J.Comp.Chem. 34 (21), 1797-1799 (2013) DOI
  3. R. Grzywa, E. Dyguda-Kazimierowicz, M. Sienczyk, M. Feliks, W. A. Sokalski, J. Oleksyszyn, The Molecular Basis of Urokinase Inhibition: From the Nonempirical Analysis of Intermolecular Interactions to the Prediction of Binding Affinity, J.Mol.Model. 13 (6-7), 677-683 (2007) DOI [available on request]
  4. J. Wang, J. Gu, J. Leszczynski, M. Feliks, W. A. Sokalski, Oxime-induced reactivation of sarin-inhibited AChE: a theoretical mechanism study, J.Phys.Chem.B 111 (9), 2404-2408 (2007) DOI

Conference presentations

  • Reactivation Mechanisms for Sarin-Inhibited Acetylcholinesterase by Oxime: A Model DFT Study, M. Feliks, Jing Wang, Jerzy Leszczynski, Modeling and Design of Molecular Materials 2006, Wroclaw, Poland (poster presentation)
  • Application of Homology Modeling to the Prediction of Janus Kinases Tertriary Structure, M. Feliks, E. Dyguda-Kazimierowicz, W. A. Sokalski, Workshop on the Structure and Function of Biomolecules II (2006), Będlewo, Poland (poster presentation)
  • Wykorzystanie Zjawiska Homologii Białek w Modelowaniu Trójwymiarowej Struktury Kinaz Janusa (JAK), M. Feliks, E. Dyguda-Kazimierowicz, W. A. Sokalski, 4th Students' Scientific Conference (KNS), Wroclaw University of Technology, May 2006 (oral presentation)