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Department

 of  Chemistry  &  


Centre  for  Biotechnology  
Brock  University  
St.  Catharines,  Ontario  
h6p://www.brocku.ca/chemistry/  
 
Brock  University  
•  Located  in  St.  Catharines,  ON  
–  Short  drive  from  Buffalo,  Niagara  
Falls,  Hamilton,  and  Toronto  
–  In  the  heart  of  the  Niagara  wine  
region  
•  ~18,000  undergraduate  students  
and  ~1500  graduate  students  
–  A  medium-­‐sized  university  with  a  
smaller-­‐school  feel  
Finding Solutions Today, for
the Challenges of Tomorrow

Behie,  SW;  Zelisko,  PM;    


Bidochka,  MJ.    
Science,  2012,  1576-­‐77  

Research  generates  >  $1  million  from  licensing   Brock  prof’s  venture  wins  business  of  the  year  
revenues  

Advanced
Biomanufacturing
Centre

Brock  signs  agreement  with  Lorus  


TherapeuOcs  Inc.  to  develop  anOcancer  drugs  
The  Department  of  Chemistry  

•  Graduate  programs  offered:  


–  MSc  in  Chemistry  
–  PhD  in  Chemistry  
–  MSc  in  Biotechnology  
–  PhD  in  Biotechnology  
•  Research  areas:  
–  AnalyOcal  chemistry  
–  Inorganic  chemistry  
–  Organic  chemistry  
–  Physical  &  computaOonal  
chemistry  
Programme and Admission
Requirements
•  Offer graduate programmes leading to
a Master of Science (MSc) and/or
Doctor of Philosophy (PhD) degree
•  Require an Hons. BSc degree (≥75%
average)
–  May be admitted to the programme with a
qualifying year if not all of the
requirements are met

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Programme and Admission
Requirements
•  Applications can be made at any time
–  Formal admission is generally September
1, January 1, or May 1
•  Applications require a recent
transcript, an Application Form, a
Statement of Interest form, and
letters from three references
–  Forms can be downloaded from the
School of Graduate Studies website
(www.brocku.ca/gradstudies/forms/)

8
Financial Support
•  Graduate students receive a research
assistantship and the opportunity to teach in
the undergraduate laboratory programme
–  Research assistantship is supplemented by
supervisor’s grants
–  Applicants are encouraged to contact the potential
supervisor prior to submitting a formal application
•  Brock graduate students are eligible for a
host of internal and external grants to
supplement their stipends

9
The Brock Advantage
Major instrumentation, just as in much
larger universities…

NMR  Spectroscopy  
(300  MHz  and  600  MHz  magnets)   10
The Brock Advantage
Major instrumentation…

Mass  spectrometry  
(MALDI-­‐TOF,  EI,  CI,  ESI,  FAB,  GC-­‐MS)  
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The Brock Advantage
Major instrumentation…

EPR  
Spectroscopy  

Gas  
HPLC  
Chromatography  

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The Brock Advantage
… with a small school feel

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The Brock Advantage

•  Proximity to major Canadian and US cities:


–  Hamilton: ~45 min. by car
–  Toronto: ~1.3 hours by car
–  Buffalo, NY: ~35 min. by car

•  All the advantages of a big city without


having to live in one!
•  Major sporting, cultural, and entertainment
events are only a short car/bus trip away
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The  Brock  Advantage  
•  Just  a  few  minutes  hike  
from  the  Chemistry  
Department  

15  
Cairns Family Health and
Biosciences Research Complex
It’s  Not  All  Work  
•  A  very  social  
department  
–  BBQs,  Christmas  parOes,  
etc.  
–  Even  a  Chemistry  band!  

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Research Interests
Chemistry and Biochemistry of Vitamin-E (Tocopherol),

Mechanism of Lipid Transfer Proteins

Jeffrey Atkinson, Brock University, Chemistry & Biotechnology

jatkin@brocku.ca  

HO
Background:  
     ŸŸ    Synthesis  and  biological  evaluaOon  of  different  
forms  of  vitamin  E   O
Results:  
     ŸŸ    Synthesis  of  deuterated  forms  of  Vitamin  E  for   α-Tocopherol,phenolic lipophilic antioxidant
biokineOc  studies   & membrane enzyme modulator
     ŸŸ    Synthesis  of  fluorescent  tocopherols  for  in  vitro   (CD3) D
HO D
and  in  vivo  lipid  transfer  studies  
     ŸŸ    Synthesis  of  tocopherol-­‐based  P450  inhibitors  
(D3C) O
     ŸŸ    Expression  of  naOve  and  mutant  human   (CD3)
tocopherol  transfer  proteins    
     ŸŸ    Protein  structure  and  funcOon  (see  Dr.  Heather   HO
Gordon)    
Fluorophore

O
ScienDfic  Uniqueness:  
Ÿ  CombinaOon  of  organic  synthesis,  protein  
     Ÿ  
chemistry,  and  molecular  biology  
     ŸŸ    First  creaOon  of  molecular  tools  for  analysis  of   Protein  mediated  
tocopherol  transfer  and  membrane     tocopherol  transfer  to  
biochemistry  by  fluorescence   and  from  biological  and  
Impact  and  Advantages:   model  membranes  can  
Ÿ  RaOonal  molecular  approach  to  vitamin  E  
     Ÿ   be  followed  by  FRET  &              
biochemisty   stopped  flow  
     ŸŸ    Strong  collaboraOons  with  nutriOonal  biochemists   fluorescence  
and  health  science  researchers  around  the  
world  

Human α-Tocopherol Transfer Protein



19  
Environmental Analytical Chemistry; Trace Element Analysis

Ian D. Brindle, Brock University, Chemistry & Biotechnology



Dean, Faculty of Mathematics and Science

ibrindle@brocku.ca  

Development  of  analyOcal  


methods  for  environmental  
and  other  samples.  Gas  
chromatography/mass  
spectrometry  and  nuclear  
magneOc  resonance  applied  
to  organometallic  species  and  
to  environmental  problems.  
Trace  and  ultra-­‐trace   Reductant
determinaOon  of  elements  in  
complex  matrices.  
ApplicaOons  of  mass  
           
Sample

spectrometry  in  analyOcal  


chemistry.    
Argon

Sample
MSIS™

(Dual Mode Operation)
20  
Computationally Directed Asymmetric Catalysis

Travis Dudding, Brock University, Chemistry & Biotechnology

tdudding@brocku.ca  
Research  Goals:  
Research  in  the  Dudding  group  focuses  on  the  use  of  
computaOonal  theory  to  gain  insight  into  the  mechanisOc    
origins  of  stereoselecOvity  in  catalyOc  asymmetric  reacOons.      
The  models  derived  from  these  studies  are  uOlized  to    
guide  the  development  of  new  stereoselecOve  catalysts  and    
asymmetric  reacOon  methodologies.  Specific  reacOons    
of  interest  are  asymmetric  Steler  and    aza-­‐Steler  reacOons,    
Brønsted  acid  catalyzed  asymmetric  procedures  and    
chiral  nucleophilic  catalyzed  annulaOons.    
 
Significance:  
The  advent  of  modern  computaOonal  chemistry  has  had  a    
profound  effect  on  chemists’  understanding  of  organic  reacOon    
mechanisms.  Through  computaOon,  chemists  are  now  frequently    
able  to  raOonalize  or  predict  the  outcome  of  experiment  with  a    
high  level  of  certainty.  In  this  respect  a  parOcularly  useful    
applicaOon  of  computaOon  relates  to  the  modeling  of  catalyOc     O
O

asymmetric  methods  with  the  obvious  end  goal  being  the  use  of    
theory  to  design  an  opOmal  catalyst  for  a  desired  chiral  chemical   O
O
transformaOon.  The  emerging  potenOal  of  in  silico  based  design        H        
H

approaches  in  asymmetric  catalysis  offers  great  promise  as  an     O


environmentally  friendly  alternaOve  for  streamlining  the  discovery     O H
process  and  lessening  the  demand  placed  upon  chemical  resources.   H

In  this  respect  the  work  being  conducted  in  the  Dudding  group  is    
making  possible  innovaOve  methods  grounded  both  in  experiment    
Sterically Defined Reaction Pocket

and  computaOon  which  allow  for  the  rapid  cost-­‐efficient  producOon    


of  chiral  pharmaceuOcals  and  highly  prized  chemicals.   21  
Monte Carlo Simulations of Model Antibody Binding Sites

Heather L. Gordon, Brock University, Chemistry & Biotechnology



gordonh@brocku.ca  
AnDbody  binding  site:  
 
6  loops  on  β-­‐barrel  framework
Research  Goals:  
To  understand  relaOonship  between  
anObody  selecOvity  and  specificity  and  the  inherently    
flexible  anOgen  binding  site.  
 
Methodology:  
Use  Monte  Carlo  simulaOons  to  sample  the    
complete  conformaOonal  distribuOon  of  a    
model  anObody  binding  site.  
    Model system:

Abstracted loops

ObjecDve:   From crystal structure.

To  characterize  the  conformaOonal  change    
Monte Carlo simulations employ

random numbers.
in  the  anObody  binding  site  in  the  presence    
and  absence  of  a  model  anOgen.    
 
Results:  
Intraloop  interacOons  are  more  influenOal  
than  interloop  interacOons  in  determining  
pepOde  loop  shape.  
 
Significance:   Isolated loop
           
Loop in

Most  consistent  with  view  that  anObody   assembly

binding  site  displays  conformaDonal  isomerism:  


AnOgen  binds  selecOvely  to  a  pre-­‐exisOng  
conformaOon  that  may  not  be  at  the  global    
minimum  in  potenOal  energy.  
Loop conformational distribution is restricted

95-97% conformations identical
when in presence of other loops.

22  
between isolated and assembled loops.

Clean Manufacturing of Pharmaceuticals via

Enzymatic and Electrochemical Methods

Tomas Hudlicky, Brock University, Chemistry and Biotechnology

thudlicky@brocku.ca  
R R alkaloids
Background:  
toluene sugars
     ŸŸ    Converson  of  toxic  aromaOc  compounds  to  chiral   OH organic
dioxygenase chemistry cyclitols
building  blocks  for  use  in  manufacturing   prostaglandins
 Results:   terpenes
OH
Ÿ    ”Green”  synthesis  of  funcOonalized  catechols  
     Ÿ polymers
     ŸŸ    Short  synthesis  of  anOtumor  agents   R = alkyl, aryl, halogen oligomers
     ŸŸ    Synthesis  of  carbohydates  and  oligoinositols  
     ŸŸ    Electrochemical  oxidaOons  and  reducOons   R R Br OH
     ŸŸ    Short  approach  to  morphine   1. toluene
OH OH
ScienDfic  Uniqueness:   dioxygenase
Ÿ    BiooxidaOon  of  aromaOcs  has  no  chemical  
     Ÿ
2. electro-
equivalent   OH
chemistry OH
     ŸŸ    Tandem  electrochemistry–enzyme  methods  are   3. H2O OH
most  efficient  
OH
     ŸŸ    Removal  of  potenOal  waste  products  by  strategic   HO
HO OH
conversion  to  value-­‐added  compounds  
Impact:   HO
OH
Ÿ  Concept  of  EffecOve  Mass  Yield  
     Ÿ   O
OH O
HO

     ŸŸ    One-­‐step  synthesis  of  funcOonalized    


OH
NH NCH3 HO
O O OH
catechols  
HO
     ŸŸ    ”No  reagent”  synthesis     OH O HO
HO
OH
O
OH            
pancratistatin morphine OH
OH
MeO
HO O OH
OH
OH
MeO HO OH L-chiro-4
OMe OH
OH
OMe
combretastatin A-1
23  
Development of Rigid Chiral N-Heterocyclic
Carbenes Derived from Phenanthrolines

Costa Metallinos, Brock University, Chemistry

metallic@brocku.ca  
Background:  N-­‐Heterocyclic  carbenes  (NHCs)  with  an  
Ph Ph
imidazolidine  framework  can  be  classified  as  one   i-Pr
of  three  general  structural  types:  (a)   Ar Ph
N N N N Ar N N Ph
Imidazolinylidenes  (1)  which  have  a  saturated  
backbone;  (b)  unsaturated  imidazolylidenes  (2),   i-Pr
and  (c)  benzimidazolylidenes  (3).  There  are  
1 2 3
comparaOvely  few  reports  of  chiral  
benzimidazolylidenes.  This  can  be  alributed  in  
part  to  limitaOons  imposed  by  tradiOonal  
syntheOc  routes,  which  have  restricted  their   NaBH3CN HC(OEt)3
structural  diversificaOon.   1 equiv HCl
  N N NH HN
80 °C
N N
ScienDfic  Uniqueness:  Previously  we  have  described  a   1,10-phenanthroline 5 6
Cl
route  to  a  rigid  tetracyclic  benzimidazolylidene   4
(7)  derived  from  phenanthroline  (4)  (Metallinos  
et  al.  Org.  Le6.  2004,  6,  3641).  The  key  step  in   Cl
0.5 equiv Pd(OAc)2 N N
the  preparaOon  of  this  ligand  involved  a   Pd
convenient  reducOon  of  the  pyridyl  rings  to  make   THF, reflux
N Cl N
octahydrophenanthroline  (5).  We  have  expanded  
this  methodology  to  prepare  enanOomerically   7
           
pure  rigid  chiral  benzimidazolium  salt  precursors  
of  benzimidazolylidenes  (e.g.  8  and  9).  Our  
approach  to  the  structural  diversificaOon  of  this   H H
sub-­‐class  of  NHCs  holds  promise  for  their  future  
applicaOons  in  asymmetric  synthesis.   N N N N
BF4 H BF4 H
8 9
24  
Organometallic and Coordination Chemistry

Georgii Nikonov, Brock University, Chemistry

gnikonov@brocku.ca  
Background  
•  TransiOon  metal  (TM)  complexes  subsOtuted  by    main  group  element  (MGE)  ligands,  i.e.  
LnM-­‐ERk,  oten  exhibit  unusual  metal-­‐ligand  and  ligand-­‐ligand  bonding;  
•  There  is  a  conOnuing  interest  in  complexes  with  mulOple  metal-­‐ligand  bonds  (silylenes,  
phosphinidenes,  borylenes  etc)  and  in  coordinaOon  of  mulOple  E=E  bonds  to  metals  
(complexes  of  disilenes,  silenes,  silaimines,  diphosphenes  etc);  
•  Much  of  current  research  is    focused  on  studying  nonclassical  interligand  interacOons.  
Research  Goals  
•  To  develop  the  chemistry  of  transiOon  metal  hydrides  in  new  ligand  environments;  
•  Synthesis,  structure  and  reacOvity  of  TM  hydrides  and  MGE    complexes;  
•  Study  of  nonclassical  interligand  interacOons.  
Methodology  
•  New  syntheOc  strategies  to  MGE  and  hydride  complexes:  
–  reacOons  of  MGE  halides  with  hydrides;  
–  selecOve  funcOonalizaOon  of  E-­‐H  bonds  in  complexes;  
–  E-­‐E  coupling  reacOons  on  TM  complexes;    
•  X-­‐ray  and  neutron  diffracOon,  NMR,  IR,  EPR,  DFT  calculaOons.  
Results  
•  Pioneering  research  on  Interligand  Hypervalent  InteracOons  
•  New  types  of  Si-­‐H...  M  agosOc  complexes  
•  New  approaches  to  diphosphene  complexes  
•  One  of  the  first  σ-­‐complexes  of  the  Si-­‐Si  bond    
Significance/Impact  
•  New  syntheOc  methodologies  
•  New  insight  into  the  nature  of  M-­‐L    
 and  L-­‐L  bonding  

25  
Developing Analytical Methods for Analyzing Environmental,
Food, and Biological Samples

Vadoud Niri, Brock University, Chemistry

vniri@brocku.ca  
Background:  
     ŸŸ    Our  research  interests  are  mostly  in  method  development  for  analyzing  different  kinds  of  samples  including  environmental  samples  
(water,  air,  soil,  plants,  etc),  food  samples  (wine,  coffee,  rice,  etc.)  and  biological  samples  (urine,  blood,  etc.)  using  different  sampling  
and  analyOcal  techniques  such  as  chromatographic  and  electranalyOcal  methods  
Environmental  Analysis:  
     ŸŸ    Obviously,  it  is  not  only  important  to  protect  our  environment  from  contaminaOon,  but  also  to  monitor  the  levels  of  contaminants  to  
ensure  that  their  concentraOon  level  is  lower  than  maximum  allowed  level.  Since  the  maximum  concentraOon  levels  for  many  
contaminants  are  low,  sensiOve  analyOcal  methods  are  required.  The  cerOfied  laboratories  which  deal  with  environmental  samples  
are  sOll  relying  on  tradiOonal  solvent  extracOon  techniques  which  are  both  hazardous  and  Ome  and  labor  consuming.  Therefore,  our  
research  focus  in  this  area  is  developing  fast,  sensiOve  and  solvent-­‐free  techniques  for  both  sampling  and  analyzing  contaminants  in  
environmental  samples  including  water,  air  and  soil.    
Food  Analysis:  
     ŸŸ    CombinaOon  of  organic  synthesis,  protein  chemistry,  and  molecular  biology  
     ŸŸ    First  creaOon  of  molecular  tools  for  analysis  of  tocopherol  transfer  and  membrane    
biochemistry  by  fluorescence  
Bioanalysis:  
     ŸŸ    Developing  highly  sensiOve  and  precise  methods  for  determinaOon  of  newly  introduced  drugs  in  pharmaceuOcal  products  and  
biological  media  is  one  of  the  challenges  in  all  pharmaceuOcal  companies  and  clinical  laboratories.  The  analyOcal  method  is  chosen  
based  on  the  chemical  properOes  of  the  drug  compounds.  While  high  performance  liquid  chromatography  (HPLC)  with  UV,  
florescence  or  mass  spectrometry  is  the  common  analyOcal  technique  for  this  purpose,  electroanalyOcal  techniques  can  also  be  used  
for  the  determinaOon  of  the  compounds  with  electrochemical  acOvity  properOes.  
Biofuels:  
ŸŸ  Biofuels  offer  an  alracOve  alternaOve  to  petroleum-­‐based  fuels.  These  fuels  can  be  created  from  different  sources  including  crop  oils  
and  biomasses.  One  of  the  challenges  in  biofuel  studies  is  to  customize  analyOcal  techniques  for  analyzing  the  products  during  the  
process.  These  techniques  will  allow  us  to  idenOfy  and  quanOfy  reacOon  products  during  the  process,  construct  a  detailed  mechanism  
and  improve  the  quality  of  the  fuel.      
 
 

26  
Novel Hybrid Organic/Inorganic Molecular
Materials
Melanie Pilkington, Brock University, Chemistry
mpilkington@brocku.ca
Background:    
   ŸŸ      Inorganic  crystal  engineering.    
Ÿ    The  preparaOon  of  magneOc,  electronic  and  opOcal  
   Ÿ  
materials  from  molecular  building  blocks.  
Results:  
     ŸŸ    Synthesis  and  characterisaOon  of  new  
tetrathiafulvalene  (TTF)    building  blocks.   A  New  TTF  DerivaOve  with  Four  
     ŸŸ    SyntheOc  strategies  for  the  preparaOon  of     Pyridine  Binding  Sites  
funcOonalised  phthalocyanines  (Pcs).  
     ŸŸ    Synthesis,  characterisaOon  and  study  of  molecule-­‐  
based  magneOc  materials  e.g.  high  spin  clusters,  3-­‐D  
networks,  1-­‐D  coordinaOon  polymers  and  spin-­‐
crossover  compounds.   A  Novel  Fully  Conjugated  Phenanthroline  
ScienDfic  Uniqueness:   Appended  Phthalocyanine.  

     Ÿ  
Ÿ  ExploiOng  the  use  of  metal  binding  sites  as  the  key  
element  for  the  construcOon  of  dual  property  hybrid  
materials.  
     ŸŸ    Target  the  synergy  between  the  properOes  of  the  
inorganic  and  organic  components  in  each  system  to  
assemble  new  materials.  
Impact  and  Advantages:  
A  High  Spin  (S  =  51/2)  [MnII9MoV6]  
Molecular  Cluster   !
     Ÿ  
Ÿ    Dual  property  materials  with    
 synergisOc  properOes.    
   ŸŸ        Development  of  new  electronic,    
 opOcal  and/or  magneOc  devices    
 that  will  be  the  cornerstones  of    
A  Three-­‐Dimensional  Bimetallic  Network  
 new  technology.   1-­‐D  MagneOc  CoordinaOon  Polymer   [NbIV{µµCN)4MnII(H2O)2}2]·∙2H27  2O  
Novel Approaches to Fundamental Problems in
Computational Chemistry and Physics

Stuart M. Rothstein, Brock University, Chemistry & Physics

srothste@brocku.ca  
Background:   Results:  
•  Chemistry:  the  factors  involved  in  the   •             Physics:  quantum  Monte  Carlo            
interacOon  of  biomolecules  with                  methods  can  sample  the      
themselves,  with  DNA,  and  with  solvent                  unknown  exact  wavefuncOon.          
are  not  well  understood.                          We  recently  discovered  how  to    
•  Physics:  one  can  derive  accurate  results                  sample  the  unknown  exact    
from  quantum  theory  by  taking                  probability  density  as  well.  
expectaOon  values  of  operators  over  the    
truly  exact  electron  distribuOon,  not  just                  We  are  applying  this  methodology    
an  approximate  one,  contaminated  by  a                  to  calculate  very  accurate  esOmates    
trial  funcOon                  of  polarizabiliOes  of  chemical    
 Results:                  systems.  
     ŸŸ    Chemistry:  Using  sophisicated  staOsOcal   ScienDfic  Uniqueness:   CRP-­‐cAMP-­‐DNA complex.  
methods  we  developed  computer  codes            Our  research  has  a  strong          
to  cluster  quantum  and  classical                      interdiscipinary  flair,  drawing    
molecular  dynamics  trajectories,  and  to                        on  computaOonal  and    
visualize  the  resulOng  clusters.  In                      theoreOcal    chemistry  and                    much-­‐needed  local  view  of    
applicaOons                        physics,  high-­‐performance                      bio-­‐molecular    interacOons.  
                 done  in  collaboraOon  with  groups  in                      compuOng  and  mathemaOcs     Impact  and  Advantages:  
Germany,  Japan,  and  Brock,  this  approach                      to  tackle  fundamental  problems.   •  Physics:  quantum  Monte  Carlo  
provided  a  local  descripOon  of  protein   Impact  and  Advantages:               approach  
is  the  most  promising  
folding,  of  non-­‐bonded  interacOons  in   •                 Chemistry:  we  extract  the  signal     to  ab  iniDo  electronic  structure  of    
biological  systems                      from  the  noise  in  biomolecular   large  molecules.  
                 (figure),  and  of  high-­‐frequency  moOons  in                    simulaOon  data  beler  than        
proteins,  associated  with  their  biological                    standard  approaches,  and  our     Group   Human αrol   Transfer Protein

website:  
funcOoning.                    visualizaOons  provide  a  novel,     hlp://www.brocku.ca/chemistry  
/faculty/Rothstein  
28  
       
Molecular Nanomagnets and Structural Models of the
Oxygen-Evolving Center of Photosystem II Based on
Multinuclear/Multifunctional 3d- and 4f-Metal Complexes

Theocharis C. Stamatatos, Brock University, Chemistry

tstamatatos@brocku.ca  
Background:  
     ŸŸ    Synthesis,  spectroscopic,  magnetochemical  and  photoluminescence  
characterizaOon,  and  biological  evaluaOon  of  mulOnuclear  3d-­‐,  4f-­‐,  
and  3d/4f-­‐metal  complexes  
Results:  
     ŸŸ    A  molecular,  ’bolom-­‐up’  approach  to  the  nanoscale  through  the  synthesis  
of  polynuclear  homo-­‐  and  hetero-­‐metallic  3d-­‐  and  4f-­‐metal  complexes  
Ÿ  Synthesis  of  mulOfuncOonal  molecular  magneOc  materials  displaying  dual  
     Ÿ   Molecular Magnetism Photoluminescence
physical  properOes     Light
     ŸŸ    Synthesis  of  new  high-­‐spin  molecules,  single-­‐molecule  magnets  and  single-­‐
chain  magnets  
     ŸŸ    Synthesis  and  detailed  study  of  analogues  (molecular  models)  of  the  
acOves  sites  of  several  redox  enzymes  
Synthetic Inorganic Chemistry
     ŸŸ    Biological  implicaOons  and  studies  for  mononuclear,  ‘low-­‐weight’  
complexes    
ScienDfic  Uniqueness:   O
Ca
Mn O
     Ÿ  
Ÿ  CombinaOon  of  inorganic  and  organic  synthesis,  coordinaOon  chemistry,   O O
Mn

magnetochemistry,  photoluminescence,  catalysis,  biology,  materials   Mn Mn

science  and  engineering   Quantum Computing


O
Bioinorganic Chemistry
Impact  and  Advantages:  
1
     Ÿ  
Ÿ  A  challenging  prospect  in  mulOnuclear  metal  cluster  chemistry  is  to   0.04 K

operate  spins  within  magneOc  coordinaOon  complexes  to  accomplish   0.5

quantum  logic  processes  (quantum  compuOng  informaOon  

M/Ms
0

processing)     0.008 T/s


-0.5 0.004 T/s

     ŸŸ    Strong  collaboraOons  with  a  wide  range  of  chemists,  physisists,  biologists   0.002
0.001
T/s
T/s

and  chemical  engineerings  around  the  world   -1


-0.8 -0.6 -0.4 -0.2 0 0.2 0.4 0.6 0.8
µ0H (T)
29  
Structure and Function of Photosynthetic Proteins

Electron Spin Resonance Spectroscopy

Art van der Est, Brock University, Chemistry & Biotechnology

avde@brocku.ca  
Goals:  
     ŸŸ    Beler  understanding  of  solar  energy  
Photosynthesis  
conversion  in  photosyntheOc  
organisms  
 Results:  
     ŸŸ    DeterminaOon  of  electron  transfer  rates  
D
in  Photosystem  I  using  electron  spin  
HO D
resonance  
     ŸŸ    Studies  of  site  directed  mutants  to  
(D3C) O
determined  the  pathway  of  electron  
(CD3)
transfer.    
     ŸŸ    Computer  modelling  dynamics  (see  Dr.  
Gordon)    
ScienDfic  Advances:  
     ŸŸ    Development  of  spin  polarizaOon  as  
effecOve  tool  for  studying  electron  
transfer.   Electron  spin  resonance  signals  
Impact:   Photosystem  I   from  photosystem  I
     Ÿ  
Ÿ  Beginning  to  unravel  the  basic  
principles  of  efficient  solar  energy              
conversion  
     ŸŸ  Strong  internaOonal  collaboraOons  with     light
sciencOsts  working  in  this  field   P P+A1-­‐ P+FX-­‐
 
 
30  
Carbohydrates, Nucleic Acids, and Bioconjugates

Hongbin (Tony) Yan, Brock University, Chemistry and Biotechnology

tyan@brocku.ca  
R1O B
O
O B
O OEt
Background O O O
•  Oligonucleotide synthesis, siRNA synthesis O O
NC P
N
•  Glycoconjugates and glycobiology X
P
O B'
NR2

•  Drug delivery O

Research Goals 2'-Cpep ribonucleoside phosphoramidite Cl


O
•  Understanding the chemistry, biochemistry, oligonucleotide phosphate-
and biology of nucleic acids, carbohydrates, phosphorothioate chimeras
and bioconjugates
Research Projects
•  Synthesis of oligonucleotide phosphate–phosphorothioate random chimeras
•  Solid phase synthesis of oligoribonucleotides/siRNAs using the Cpep chemistry
•  Novel siRNA analogues
Applied Biosystem 3400 DNA Synthesizer

•  Chemical mimicry of bacterium Pseudomonas aeruginosa surface
carbohydrate-binding proteins – carbohydrate interactions
carbohydrate
Significance
•  Methodology for the synthesis of oligoribonucleotides on multi-gram scales
•  Understanding lectin–carbohydrate interactions Cationic lipid

•  Development of bioconjugates pertinent to human health Neutral lipid

Glycoliposome
31
Organosilicon Chemistry and the Chemistry of
Silicone and Silicone-Modified Materials

Paul Zelisko, Brock University, Chemistry and Biotechnology

pzelisko@brocku.ca  

•  The  goals  of  this  research  are:  (1)  to  


invesOgate  the  interacOon(s)  of  silicon-­‐based  
molecules  with  biological  systems;  (2)  to  
develop  systems  where  enzymes  can  be  used  
to  perform  chemistry  at,  or  near,  silicon  in  
1.0  
place  of  the  more  tradiOonal,  and  somewhat  
more  toxic/expensive,  metal-­‐based  catalyst  

RelaDve  proporDon  of  29Si  integral  of  


0.9  
systems;  and  to  (3)  explore  applicaOons  such  
0.8  
as  biomaterials,  drug  delivery  devices,  

phenyltrimethoxysilane  
sealants,  coaOngs,  and  agriculture  products  to   0.7  
name  but  a  few.  
0.6  
0.5  
0.4  

O
O
Si 1
2
Si
O
3
Si
n O
2
Si
O
Si 1
O 0.3  
3 O
O
TES-PDMS
0.2  
Cross-linking

enzyme   2 1 0.1  
Spinning
0.0  
Dn   side band
0   2   4   6   8   10  
Time  (hr)  
32  
For more information visit us at:

www.brocku.ca/chemistry
www.brocku.ca/gradstudies
www.brocku.ca/biotechnology

Application forms for graduate studies:


www.brocku.ca/gradstudies/forms/

Or contact Prof. Tony Yan at:


tyan@brocku.ca
41
43

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