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 Bibliografske baze podataka

 
 
 
Verzija za printanje   
 
  Uredničke knjige
 

1. The 3rd Adriatic Meeting on Computational Solutions in Life Sciences : book of abstracts / Babić, Darko; Došlić, Nadja; Smith, David; Tomić, Sanja; Vlahoviček, Kristian (ur.).
Zagreb : Institute of Computational Life Sciences (ICLS), 2009 (zbornik).

2. The 2nd Opatija Meeting on Computational Solutions in Life Sciences : book of abstracts / Babić, Darko; Došlić, Nadja; Smith, David; Tomić, Sanja; Vlahoviček, Kristian (ur.).
Zagreb : Institute of Computational Life Sciences (ICLS), 2007 (zbornik).
Vrh
 
  Poglavlja u knjizi
 

1. Sandala, Greg; Smith, David M.; Radom, Leo.
Theoretical Studies of Radical Enzymes // Encyclopedia of Radicals in Chemistry, Biology and Materials / Chatgilialoglu, C. ; Studer, A. (ur.).
Chichester : John Wiley & Sons, 2012. Str. 1547-1576.
Vrh
 
  Izvorni znanstveni i pregledni radovi u CC časopisima
 

1. Barić, Danijela; Dragičević, Ivan; Kovačević, Borislav.
Cyclopropenimine as a hydrogen bond acceptor— towards the strongest non-phosphorus superbases. // Tetrahedron. 70 (2014) , 45; 8571-8576 (članak, znanstveni). URL link to workURL link to work

2. Barić, Danijela; Dragičević, Ivan; Kovačević, Borislav.
Design of Superbasic Guanidines: The Role of Multiple Intramolecular Hydrogen Bonds. // Journal of organic chemistry. 78 (2013) , 8; 4075-4082 (članak, znanstveni). URL link to workURL link to work

3. Hioe, Johnny; Mosch, Marianne; Smith, David M.; Zipse, Hendrik.
Dissociation energies of Cα–H bonds in amino acids – a re-examination. // RSC Advances. 3 (2013) ; 12403-12408 (članak, znanstveni). URL link to workURL link to work

4. Kögel, Julius F; Oelkers, Benjamin; Kovačević, Borislav; Sundermeyer, Jörg.
A New Synthetic Pathway to the Second and Third Generation of Superbasic Bisphosphazene Proton Sponges : The Run for the Best Chelating Ligand for a Proton. // Journal of the American Chemical Society. 35 (2013) , 47; 17768-17774 (članak, znanstveni). URL link to workURL link to work

5. Brkljača, Zlatko; Čondić-Jurkić, Karmen; Smith, Ana-Sunčana; Smith, David M.
Calculation of the CD spectrum of a peptide from its conformational phase space: The case of Met-enkephalin and its unnatural analogue. // Journal of chemical theory and computation. 8 (2012) , 5; 1694-1705 (članak, znanstveni). URL link to workURL link to work

6. Bucher, Denis; Sandala, Gregory M.; Durbeej, Bo; Radom, Leo; Smith, David Matthew.
The Elusive 5'-Deoxyadenosyl Radical in Coenzyme-B12-Mediated Reactions. // Journal of the American Chemical Society. 134 (2012) , 3; 1591-1599 (članak, znanstveni). URL link to workURL link to work

7. Čondić-Jurkić, Karmen; Smith, Ana-Sunčana; Zipse, Hendrik; Smith, David M.
The Protonation States of the Active-Site Histidines in (6-4) Photolyase. // Journal of Chemical Theory and Computation. 8 (2012) , 3; 1078-1091 (članak, znanstveni). URL link to workURL link to work

8. Maksić, Zvonimir; Kovačević, Borislav; Vianello, Robert.
Advances in Determining the Absolute Proton Affinities of Neutral Organic Molecules in the Gas Phase and Their Interpretation : A Theoretical Account. // Chemical reviews. 112 (2012) , 10; 5240-5270 (članak, znanstveni). URL link to workURL link to work

9. Babić, Darko; Ćurić, Manda; Smith, David Matthew.
Computational study of the cyclopalladation mechanism of azobenzene with PdCl2 in N, N-dimethylformamide. // Journal of organometallic chemistry. 696 (2011) , 3; 661-669 (članak, znanstveni). URL link to workURL link to work

10. Dörr, Felipe A.; Kovačević, Borislav; Maksić, Zvonimir B.; Pinto, Ernani; Volmer, Dietrich A.
Intriguing Differences in the Gas-Phase Dissociation Behavior of Protonated and Deprotonated Gonyautoxin Epimers. // Journal of the American Society for Mass Spectrometry. 22 (2011) , 11; 2011-2020 (članak, znanstveni). URL link to workURL link to work

11. Tomić, Antonija; Abramić, Marija; Špoljarić, Jasminka; Agić, Dejan; Smith, David M.; Tomić, Sanja.
Human Dipeptidyl Peptidase III: Insights into Ligand Binding from a Combined Experimental and Computational Approach. // Journal of molecular recognition. 24 (2011) , 5; 804-814 (članak, znanstveni). URL link to workURL link to work

12. Čondić-Jurkić, Karmen; Zipse, Hendrik; Smith, David Matthew.
A Compound QM/MM Procedure: Comparative Performance on a Pyruvate Formate-Lyase Model System. // Journal of computational chemistry. 31 (2010) , 5; 1024-1035 (članak, znanstveni). URL link to workURL link to work

13. Parthasarathy, Anutthaman; Buckel, Wolfgang; Smith, David M.
On the thermodynamic equilibrium between (R)-2-hydroxyacyl-CoA and 2-enoyl-CoA. // The FEBS journal. 277 (2010) , 7; 1738-1746 (članak, znanstveni). URL link to workURL link to work

14. Sandala, Gregory M.; Smith, David M.; Radom, Leo.
Modeling the Reactions Catalyzed by Coenzyme B12 Dependent Enzymes. // Accounts of chemical research. 43 (2010) , 5; 642-651 (članak, znanstveni). URL link to workURL link to work

15. Durbeej, Bo; Sandala, Gregory M.; Bucher, Denis; Smith, David M.; Radom, Leo.
On the Importance of Ribose Orientation in the Substrate Activation of the Coenzyme B12-Dependent Mutases. // Chemistry - A European Journal. 15 (2009) , 34; 8578-8585 (članak, znanstveni). URL link to workURL link to work

16. Sandala, Gregory M.; Kovačević, Borislav; Barić, Danijela; Smith, David M.; Radom, Leo.
On the Reaction of Glycerol Dehydratase with But-3-ene-1, 2-diol. // Chemistry : a European journal. 15 (2009) , 19; 4865-4873 (članak, znanstveni). URL link to workURL link to work

17. Čondić-Jurkić, Karmen; Perchyonok, V. Tamara; Zipse, Hendrik; Smith, David M.
On the modeling of arginine-bound carboxylates: A case study with Pyruvate Formate-Lyase. // Journal of computational chemistry. 29 (2008) , 14; 2425-2433 (članak, znanstveni). URL link to workURL link to work

18. Sandala, Gregory M.; Smith, David; Radom, Leo.
The Carbon-Skeleton Rearrangement in Tropane Alkaloid Biosynthesis. // Journal of the American Chemical Society. 130 (2008) , 32; 10684-10690 (članak, znanstveni). URL link to work

19. Wood, Geoffrey P. F.; Gordon, Mark S.; Radom, Leo; Smith, David M.
The Nature of Glycine and its alpha-Carbon Radical in Aqueous Solution: A Theoretical Investigation. // Journal of chemical theory and computation. 4 (2008) , 10; 1788-1794 (članak, znanstveni). URL link to workURL link to work

20. Kouskoulli, M. A.; Smith, David M.; Nicolaides, A. V.
Estimating the pi-bond energies and the stabilities of oxy-substituted carbocations. // Journal of Molecular Structure - Theochem. 811 (2007) , 1-3; 355-359 (članak, znanstveni).

21. Sandala, Gregory M.; Smith, David M.; Marsh E. Neil G.; Radom, Leo.
Toward an Improved Understanding of the Glutamate Mutase System. // Journal of the American Chemical Society. 129 (2007) , 6; 1623-1633 (članak, znanstveni).
Vrh
 
  Znanstveni radovi u drugim časopisima
 

1. Babić, Darko; Kazazić, Saša; Smith, David Matthew.
Kinetics of H/D Exchange by Mass Spectrometry. I. Analysis of a Single Exchange Profile. // MATCH : communications in mathematical and in computer chemistry. 70 (2013) , 3; 801-827 (članak, znanstveni). prilozen text radaURL link to work

2. Babić, Darko; Klein, Douglas J.; Smith, David Matthew.
Staggered Benzenoid Pairs as Potential Spin Coupling Systems. // MATCH : communications in mathematical and in computer chemistry. 69 (2013) , 3; 649-676 (članak, znanstveni). prilozen text radaURL link to work
Vrh
 
  Plenarna izlaganja
 

1. Smith, David M; Bucher, Denis; Sandala, Gregory M; Durbeej, Bo; Radom, Leo.
An Elusive Radical Intermediate in the Coenzyme-B12-Mediated Reactions // From Solid State To BioPhysics VI - 'From Basic To Life Sciences'.
(plenarno predavanje,sažetak). URL link to work

2. Smith, David M.
Studying Enzymatic Mechanism with QM/MM Techniques: An Application to Glycerol Dehydration // The 24th Molecular Modelling Workshop Book of Abstracts.
2010. 28-28 (plenarno predavanje,sažetak,znanstveni). URL link to work
Vrh
 
  Sažeci u zbornicima skupova
 

1. Čondić-Jurkić, Karmen; Smith, Ana-Sunčana; Smith, David M.
Acetylation as a Trigger of Conformational Changes in PFL Catalysis // .
(predavanje,sažetak,znanstveni).

2. Čondić-Jurkić, Karmen; Smith, Ana-Sunčana; Smith, David M.
Potential Coupling of Chemical and Conformational Changes in Pyruvate Formate-Lyase During the Catalysis // .
(poster,sažetak,znanstveni).

3. Kovačević, Borislav; Barić, Danijela; Sandala, Gregory; Smith, David Matthew; Radom, Leo.
QM/MM study of the inactivation of B12-dependent dehydratases by substrate glycerol. // .
1-1 (predavanje,sažetak,znanstveni).

4. Barić, Danijela.
Kemija in silico – kako virtualni eksperimenti postaju stvarnost // Dani kemije - knjiga sažetaka / Martinović, A., Talić, S., Mišković, I. (ur.).
Mostar : Fakultet prirodoslovno-matematičkih i odgojnih znanosti Sveučilišta u Mostaru, 2012. 17-17 (pozvano predavanje,domaća recenzija,sažetak,znanstveni).

5. Barić, Danijela; Kovačević, Borislav; Sandala, Gregory, M.; Radom, Leo; Smith, David, M.
Sucidal Inactivation of B12-dependent Dehydratases – QM//MM Study // ICPOC 21: Book of Abstracts / Williams, I., Butts, C., Buurma, M., Croft, A. (ur.).
Durham : RSC, IUPAC, 2012. B09-B09 (predavanje,međunarodna recenzija,sažetak,znanstveni).

6. Kovačević, Borislav; Barić, Danijela; Sandala, Gregory; Smith, David M; Radom, Leo.
QM/MM study of the inactivation of B12-dependent dehydratases by substrate glycerol. // X Girona Seminar on Theoretical and Computational Chemistry for the Modeling of Biochemical Systems: From Theory to Applications / Miguel Sola (ur.).
Girona : Institut de Quimica Computational, 2012. 64-64 (predavanje,međunarodna recenzija,sažetak,znanstveni). URL link to work

7. Smith, David M.; Bucher, Denis; Sandala, Gregory M.; Durbeej, Bo; Radom Leo.
The Elusive 5'-Deoxyadenosyl Radical in Coenzyme-B12-Mediated Reactions // BIT's 3rd Annual World DNA and Genome Day / Mei, Xiaodan (ur.).
Dalian, 2012. 50-50 (pozvano predavanje,sažetak,znanstveni).

8. Brkljača, Zlatko; Smith, Ana-Sunčana; Smith, David M.
Conformational study of small peptides and their circular dichroism spectra // WATOC Poster Abstracts.
(poster,sažetak,znanstveni). prilozen text rada

9. Čondić-Jurkić, Karmen; Smith, Ana-Sunčana; Zipse, Hendrik; Smith, David M.
The Protonation States of Histidines in the Active Site of (6-4) Photolyase // WATOC Poster Abstracts.
(poster,sažetak,znanstveni).

10. Miličević, Zoran; Mališ, Momir; Marrink, Siewert-Jan; Smith, David M.; Smith, Ana-Sunčana.
The ordering of water around hydrophobic solutes in electric fields // WATOC Poster Abstracts.
(poster,sažetak,znanstveni). prilozen text rada

11. Brkljača, Zlatko; Smith, Ana-Sunčana; Smith, David M.
Conformational study of small peptides and its relation to circular dichroism spectroscopy // The 25th Molecular Modelling Workshop Book of Abstracts.
31-31 (predavanje,sažetak,znanstveni).

12. Čondić-Jurkić, Karmen; Smith, Ana-Sunčana; Zipse, Hendrik; Smith, David M.
New insights in the protonation states fo active- site histidines in (6-4) photolyase // 25th Molecular Modelling Workshop 2011.
34-34 (predavanje,sažetak).

13. Miličević, Zoran; Mališ, Momir; Marrink, Siewert-Jan; Smith, David M.; Smith, Ana-Sunčana.
Water ordering around small hydrophobic solutes in electric fields // The 25th Molecular Modelling Workshop Book of Abstracts.
24-24 (predavanje,sažetak,znanstveni).

14. Barić, Danijela; Kovačević, Borislav; Sandala, Gregory M.; Radom, Leo; Smith, David Matthew.
Glycerol as a Substrate and Inactivator of B12-dependent Dehydratases - a QM/MM Study // Poster sesion III of the Ninth triennial congress of the World Association of Theoretical and Computational Chemists, Santiago de Compostela.
2011. 1-1 (poster,sažetak).

15. Smith, David M.; Bucher, Denis; Sandala, Gregory M.; Durbeej, Bo; Radom, Leo.
The Activation of Coenzyme B12 // Invited Lectures of the Ninth Triennial Congress of the World Association of Theoretical and Computational Chemists.
2011. 220-220 (pozvano predavanje,sažetak,znanstveni).

16. Smith, David M.
Insights into the Mechansim of Glycerol Dehydratase through QM/MM calculations // Gordon Research Conference on Computational Chemistry.
(predavanje,sažetak,znanstveni). URL link to work

17. Smith, David M.; Kovačević, Borislav; Barić, Danijela; Sandala, Gregory M.; Radom, Leo.
A QM/MM Insvestigation of Enzymatic Diol Dehydration // From Solid State To BioPhysics V - 'From Physics To Life Sciences'.
(poster,sažetak).

18. Brkljača, Zlatko; Smith, David M.
Replica-Exchange Molecular Dynamics Studies on Natural and Non-Natural Opioid Peptides // Book of Abstracts, Australia-Croatia Workshop on Antimicrobial Peptides and Summer School in Biophysics PhD Programme: AMP2010 / Juretić, Davor ; Separović, Frances ; Bitunjac, Irena ; Simunić, Juraj (ur.).
Split : Faculy of Science, University of Split, 2010. 24-24 (pozvano predavanje,sažetak,znanstveni).

19. Čondić-Jurkić, Karmen; Zipse, Hendrik; Carell, Thomas; Smith, David Matthew.
An MD and QM/MM Study of the Active Site of (6-4) Photolyase // SFB749 Meeting, Kloster Irsee / Carell, Birgit (ur.).
München : Ludwig-Maximilians-Universitat, 2010. 1-1 (poster,sažetak).

20. Kovačević, Borislav; Barić, Danijela; Sandala, Gregory M.; Smith, David M.
On the mechanism of biological glycerol dehydration using QM/MM techniques // 2010 International Chemical Congress of Pacific Basin Societies.
Lahti, 2010. TECH-173-TECH-173 (pozvano predavanje,sažetak,znanstveni).

21. Miličević, Zoran; Smith, David M.; Marrink, Siewert-Jan; Smith, Ana Sunčana.
The study of hydrophobic solvation by molecular dynamics simulations // The 24th Molecular Modelling Workshop Book of Abstracts.
2010. 14-14 (poster,sažetak,znanstveni).

22. Smith, David M.; Kovačević, Borislav; Barić, Danijela; Sandala, Gregory M.; Radom Leo.
Subtle Differences with Important Consequences in Enzymatic Diol Dehydration // The 5th Central European Conference – Chemistry towards Biology. Book of Abstracts / Abramić, Marija ; Maksić, Zvonimir ; Salopek-Sondi, Branka ; Tomić, Sanja ; Vianello, Robert (ur.).
Zagreb : Institut Ruđer Bošković, 2010. 53-53 (pozvano predavanje,sažetak,znanstveni).

23. Smith, David M.
Studying Enzymatic Mechanism with QM/MM Techniques: An Application to the Dehydration of Glycerol // Seventh International Conference of Computational Methods in Sciences and Engineering (ICCMSE 2009) Book of Abstracts.
(pozvano predavanje,sažetak,znanstveni).

24. Kovačević, Borislav; Sandala, Gregory; Barić, Danijela; Radom, Leo; Smith, David Matthew.
On the Reaction of Glycerol Dehydratase and But-3-ene-1, 2-diol // Vitamin B12 & Corphins, Organometallic Life on Earth, From Microorganisms to Humans.
1-1 (poster,sažetak).

25. Smith, David M.
A Computational Perspecitve on Glycerol Dehydration: To B12 or not to B12 // Vitamin B12 & Corphins, Organometallic Life on Earth: From Microorganisms to Humans.
(pozvano predavanje,sažetak,znanstveni).

26. Barić, Danijela; Kovačević, Borislav; Sandala, Gregory M.; Smith, David Matthew; Radom, Leo.
Computational Investigation of Enzymatic Dehydration of Glycerol // The 3rd Adriatic Meeting on Computational Solutions in the Life Sciences, Book of Abstracts / Babić, Darko ; Došlić, Nadja ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristijan (ur.).
Zagreb : Centre for Computational Solutions in Life Sciences, Rudjer Boskovic Institute, 2009. 31-31 (predavanje,sažetak,znanstveni).

27. Čondić-Jurkić, Karmen; Zipse, Hendrik; Carell, Thomas; Smith, David M.
Possible Protonation States of Histidines in the Active Site of (6-4) Photolyase // The 3rd Adriatic Meeting On Computational Solutions in the Life Sciences 2009 / Babić, Darko ; Došlić, Nađa ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristian (ur.).
Zagreb : Centre for Computational Solutions in Life Sciences (IRB), 2009. 52-52 (poster,sažetak,znanstveni).

28. Kovačević, Borislav; Barić, Danijela; Sandala, Gregory M.; Sandala, Radom, Leo; Smith, David M.
A Computational Investigation Of Glycerol Dehydration: To B12 Or Not To B12 // XXI. Hrvatski skup kemičara i kemijskih inženjera Knjiga sažetaka / Novak, Predrag : Pičuljan, Katarina : Smolec, Sonja (ur.).
Zagreb : Petrokemija Kutina, 2009. 47-47 (pozvano predavanje,sažetak).

29. Kovačević, Borislav; Barić, Danijela; Smith, David Matthew; Sandala, Gregory M.; Radom, Leo.
Computational Study of the Catalytic Mechanism of B12-Independent Glycerol Dehydratase (GDH) // The 3rd Adriatic Meeting on Computational Solutions in Life Sciences, Book of Abstracts / Babić, Darko ; Došlić, Nadja ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristijan (ur.).
Zagreb : Centre for Computational Solutions in Life Sciences, Rudjer Boskovic Institute, 2009. 61-61 (poster,sažetak,znanstveni).

30. Miličević, Zoran; Smith, David M.; Marrink, Siewert-Jan; Smith, Ana Sunčana.
The study of the hydration of hydrophobic particles by molecular dynamics simulations // Book of Abstracts. The 3rd Adriatic Meeting On Computational Solutions in the Life Sciences / Babić, Darko ; Došlić, Nađa ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristian (ur.).
Zagreb : Institute of Computational Life Sciences (ICLS), 2009. 67-67 (poster,sažetak,znanstveni).

31. Kovačević, Borislav; Barić, Danijela; Sandala, Greg M.; Radom, Leo; Smith, David M.
Computational Investigations of Enzyme Mechanisms: An Application to Glycerol Dehydration // TACC 2008 Book of Abstracts.
(pozvano predavanje,sažetak,znanstveni).

32. Barić, Danijela; Sandala, Gregory M.; Sandala, Radom, Leo; Smith, David M.
Coenzyme B12-Dependent Fermentation of Glycerol - A Computational Study // WATOC 2008 Book of Abstracts.
2008. (poster,međunarodna recenzija,sažetak,znanstveni).

33. Čondić-Jurkić, Karmen; Zipse, Hendrik; Smith, David M.
A Comparison of Reactivity of Natural Substrate Pyruvate and of the Inhibitor Oxamate in Pyuvate Formate-Lyase // WATOC 2008 Abstracts (Poster Session 3).
Sydney, 2008. PP484 (poster,sažetak,znanstveni).

34. Kovačević, Borislav; Barić, Danijela; Sandala, Greg M.; Radom, Leo; Smith, David M.
Computational Investigation of Enzyme Mechanisms: An Application to the B12-Independent Glycerol Dehydratase // Trends in Enzymology "Perspectives en Enzymologie" / Miller, Susan ; Badet, Bernard (ur.).
2008. (pozvano predavanje,sažetak,znanstveni). URL link to work

35. Kovačević, Borislav; Barić, Danijela; Sandala, Greg M.; Radom, Leo; Smith, David M.
Computational Investigations of Enzyme Mechanisms: An Application to the Dehydration of 1, 2-Diols // International Conference including Biophysics Summer School From Solid State to BioPhysics IV.
2008. (pozvano predavanje,sažetak,znanstveni).

36. Kovačević, Borislav; Barić, Danijela; Sandala, Greg M.; Radom, Leo; Smith, David M.
Computational Investigations of Enzyme Mechanisms: An Application to the Diol Dehydration // WATOC 2008 Book of Abstracts.
2008. IL076 (pozvano predavanje,sažetak,znanstveni).

37. Kovačević, Borislav; Sandala, Gregory M.; Radom, Leo; Smith, David M.
A QM/MM Investigation of the Catalytic Mechanism of Coenzyme B12-Independent Glycerol Dehydratase // WATOC 2008 Book of Abstracts.
2008. (poster,međunarodna recenzija,sažetak,znanstveni).

38. Smith, David M.
Theoretical Studies of Coenzyme B12-Dependent Reactions: Recent Developments // The 1st Split Meeting on Development and Applications of Novel Methods and Models in Computational Biophysics and Structural Bioinformatics.
(pozvano predavanje,sažetak,znanstveni).

39. Smith, David M.
The Integrated Molecular Orbital Approach to Accurate Calculations of Large Molecular Systems // Mathematical Methods in Chemistry 2007, MMC 2007, Program and Book of Abstracts.
(pozvano predavanje,sažetak,znanstveni).

40. Smith, David M.
Theoretical Studies of Coenzyme B12-Dependent Reactions: What Can Small Models Tell Us? // The 2007 Gordon Research Conference on Vitamin B12 and Corphins.
(pozvano predavanje,sažetak,znanstveni).

41. Čondić-Jurkić, Karmen; Zipse, Hendrik; Smith, David M.
A Computational Study of Substrate Mechanism of Pyruvate-Formate Lyase // Density Functional Theory in Physics and Chemistry (DFT 07).
Amsterdam : Stichting HRSMC Congresorganisatie, 2007. 103 (poster,sažetak,znanstveni).

42. Čondić-Jurkić, Karmen; Zipse, Hendrik; Smith, David M.
A Computational Study of Substrate Mechanism of Pyruvate-Formate Lyase // Book of Abstracts, The 2nd Opatija Meeting on Computational Solutions in Life Sciences / Babić, Darko ; Došlić, Nađa ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristian (ur.).
Zagreb : Center for Computational Solutions in the Life Sciences, 2007. 67 (poster,sažetak,znanstveni).

43. Golding, Bernard T.; Buckel, Wolfgang; Smith, David M.
Experimental and theoretical models for the reaction pathways of radical enzymes // The 2nd Opatija Meeting on Computational Solutions in the Life Sciences, Book of Abstracts / Babić, Darko ; Došlić, Nađa ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristian (ur.).
Zagreb, 2007. 48 (pozvano predavanje,sažetak,znanstveni).

44. Nakata, Kazuhide; Smith, David M.; Zipse, Hendrik.
Radical-induced acidity enhancements // The 2nd Opatija Meeting on Computational Solutions in the Life Sciences, Book of Abstracts / Babić, Darko ; Došlić, Nađa ; Smith, David ; Tomić, Sanja ; Vlahoviček, Kristian (ur.).
Zagreb, 2007. 47 (pozvano predavanje,sažetak,znanstveni).
Vrh
 
  Neobjavljena sudjelovanja na skupovima
 

1. Brkljača, Zlatko; Smith, Ana-Sunčana; Smith, David M.
Conformational study of small peptides and relation to spectroscopy // .
(predavanje,neobjavljeni rad,znanstveni).

2. Čondić-Jurkić, Karmen.
Computational methods in studying catalytic processes // .
(predavanje,neobjavljeni rad,znanstveni).

3. Miličević, Zoran; Smith, David M.; Smith, Ana-Sunčana.
Water ordering around small hydrophobic particles in electric fields // .
(predavanje,neobjavljeni rad,znanstveni).

4. Brkljača, Zlatko; Smith, Ana-Sunčana; Smith, David M.
Conformational study of Met-enkephalin and its unnatural analogue using molecular dynamics // .
1-1 (poster,neobjavljeni rad,znanstveni). prilozen text rada

5. Miličević, Zoran; Smith, David M.; Smith, Ana-Sunčana.
Electrophoretic mobility of hydrophobic particles // .
1-1 (poster,neobjavljeni rad,znanstveni). prilozen text rada

6. Čondić-Jurkić, Karmen; Smith, David M.
Differential Binding Affinity to PFL of Substrate Pyruvate and Inhibitor Oxamate From Thermodynamic Cycle // .
(poster,neobjavljeni rad,znanstveni).

7. /.
/ // /.
(neobjavljeni rad,znanstveni).
Vrh
 
  Disertacije
 

1. Čondić-Jurkić, Karmen.
Strategies in the Computational Modelling of Biological Systems: Case Studies with Radical Enzymes / doktorska disertacija.
Erlangen, Njemačka : Naturwissenschaftliche Fakultät, 02.07. 2013, 208 str. Voditelj: Smith, David M, ; Smith, Ana-Sunčana.URL link to work
Vrh
 

Zbog završnih aktivnosti vezano uz migraciju CROSBI-ja na CroRIS platformu unos i uređivanje zapisa neće biti moguć u razdoblju od petka 7.7.2023. u 12 sati do ponedjeljka 11.7.2023.

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