Chromophore twisting in the excited state of a photoswitchable fluorescent protein captured by time-resolved serial femtosecond crystallography N Coquelle, M Sliwa, J Woodhouse, G Schirò, V Adam, A Aquila, ... Nature Chemistry 10 (1), 31-37, 2018 | 190 | 2018 |
Photoswitching mechanism of a fluorescent protein revealed by time-resolved crystallography and transient absorption spectroscopy J Woodhouse, G Nass Kovacs, N Coquelle, LM Uriarte, V Adam, ... Nature communications 11 (1), 741, 2020 | 70 | 2020 |
Structural basis for a Kolbe-type decarboxylation catalyzed by a glycyl radical enzyme BM Martins, M Blaser, M Feliks, GM Ullmann, W Buckel, T Selmer Journal of the American Chemical Society 133 (37), 14666-14674, 2011 | 67 | 2011 |
Oxime-induced reactivation of sarin-inhibited AChE: a theoretical mechanisms study J Wang, J Gu, J Leszczynski, M Feliks, WA Sokalski The Journal of Physical Chemistry B 111 (9), 2404-2408, 2007 | 54 | 2007 |
Glycerol Dehydratation by the B12-Independent Enzyme May Not Involve the Migration of a Hydroxyl Group: A Computational Study M Feliks, GM Ullmann The Journal of Physical Chemistry B 116 (24), 7076-7087, 2012 | 40 | 2012 |
Catalytic mechanism of the glycyl radical enzyme 4-hydroxyphenylacetate decarboxylase from continuum electrostatic and QC/MM calculations M Feliks, BM Martins, GM Ullmann Journal of the American Chemical Society 135 (39), 14574-14585, 2013 | 39 | 2013 |
On the control of the proton current in the voltage-gated proton channel Hv1 M Lee, C Bai, M Feliks, R Alhadeff, A Warshel Proceedings of the National Academy of Sciences 115 (41), 10321-10326, 2018 | 33 | 2018 |
Structural determinants of improved fluorescence in a family of bacteriophytochrome-based infrared fluorescent proteins: Insights from continuum electrostatic calculations and … M Feliks, C Lafaye, X Shu, A Royant, M Field Biochemistry 55 (31), 4263-4274, 2016 | 32 | 2016 |
The molecular basis of urokinase inhibition: from the nonempirical analysis of intermolecular interactions to the prediction of binding affinity R Grzywa, E Dyguda-Kazimierowicz, M Sieńczyk, M Feliks, WA Sokalski, ... Journal of Molecular Modeling 13, 677-683, 2007 | 27 | 2007 |
Low cost prediction of relative stabilities of hydrogen bonded complexes from atomic multipole moments for overly short intermolecular distances W Beker, KM Langner, E Dyguda‐Kazimierowicz, M Feliks, WA Sokalski Journal of Computational Chemistry 34 (21), 1797-1799, 2013 | 10 | 2013 |
Norovirus RNA‐dependent RNA polymerase: A computational study of metal‐binding preferences MM Shaik, N Bhattacharjee, M Feliks, KKS Ng, MJ Field Proteins: Structure, Function, and Bioinformatics 85 (8), 1435-1445, 2017 | 8 | 2017 |
Pcetk: A pDynamo-based Toolkit for Protonation State Calculations in Proteins M Feliks, MJ Field Journal of Chemical Information and Modeling 55 (10), 2288-2296, 2015 | 7 | 2015 |
Predicting substituent effects on activation energy changes by static catalytic fields M Chojnacka, M Feliks, W Beker, WA Sokalski Journal of Molecular Modeling 24, 1-5, 2018 | 5 | 2018 |
Catalytic mechanism of peptidoglycan deacetylase: A computational study N Bhattacharjee, M Feliks, MM Shaik, MJ Field The Journal of Physical Chemistry B 121 (1), 89-99, 2017 | 5 | 2017 |
Free energy calculations in enzymes using the paradynamics approach M Feliks, A Warshel ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 251, 2016 | | 2016 |
Time-Resolved Serial Femtosecond Crystallography On Photoswitchable Fluorescent Proteins M Weik, N Coquelle, M Sliwa, J Woodhouse, G Schiro, V Adam, A Aquila, ... ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES 72, S39-S39, 2016 | | 2016 |
Computational Modeling of Catalytic Mechanisms of Glycyl Radical Enzymes M Feliks | | 2014 |
P-11:-Application of Homology Modelling in Tertriary Structure Prediction of Janus Kinases M Feliks, E Dyguda-Kazimierowicz, WA Sokalski EUROPHYSICS CONFERENCE ABSTRACTS ECA 30 (C), 60, 2006 | | 2006 |
Supporting Online Material BM Martins, M Blaser, M Feliks, GM Ullmann, W Buckel, T Selmer | | |