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Symposium Y: Biomineral Interfaces--From Experiment to Theory

Symposium Y: Biomineral Interfaces--From Experiment to Theory Image

SYMPOSIUM Y

Y: Biomineral Interfaces--From Experiment to Theory
December 1 - 2, 2008
Chairs
John H. Harding     University of Sheffield
James A. Elliott     University of Cambridge
John S. Evans     New York University

Symposium Support
University of Sheffield, Dept of Engineering Materials


* Invited paper

SESSION Y1: The Organic/mineral Interface
Chairs: James Elliott and John Harding
Monday Morning, December 1, 2008
Berkeley A/B (Sheraton)

8:30 AM *Y1.1
Biomineral Formation: Spectromicroscopy Experiments and Theoretical Simulations. Pupa Gilbert1, Rebecca A Metzler1, Susan N Coppersmith1, John S Evans2, Fred Wilt3, Elia Beniash4, Peter Rez5, Yael Politi6, Yurong Ma6, Steve Weiner6 and Lia Addadi6; 1Physics, University of Wisconsin, Madison, Wisconsin; 2NYU, New York, New York; 3UC, Berkeley, California; 4UPitt, Pittsburg, Pennsylvania; 5ASU, Tempe, Arizona; 6Weizmann Institute of Science, Rehovot, Israel.

9:00 AM Y1.2
Formation of Calcium Carbonate Crystal on DPPC Monolayer. Tapanendu Kamilya, Prabir Pal, Mrityunjoy Mahato and Gautam Buddha Talapatra; Spectroscopy, Indian Association for the Cultivation of Science, Kolkata, India.

9:15 AM Y1.3
Molecular Dynamics Simulations of Organic-Acid Adsorption on Calcite. Donald Mkhonto1 and Nita Sahai1,2; 1Geology and Geophysics, University of Wisconsin, Madison, Wisconsin; 2Department of Chemistry, University of Wisconsin, Madison, Wisconsin.

9:30 AM Y1.4
Possible Fuction of the Pinctada Fucata Nacre Protein n16. Rebecca Ann Metzler1, John S Evans2, Christopher E Killian3, Mike Abrecht4, Susan N Coppersmith1 and Pupa Gilbert1; 1Physics, University of Wisconsin at Madison, Madison, Wisconsin; 2Center for Biomolecular Materials Spectroscopy, Laboratory for Chemical Physics, New York University, New York, New York; 3Molecular and Cell Biology, University of California- Berkeley, Berkeley, California; 4Synchrotron Radiation Center, Stoughton, Wisconsin.

9:45 AM Y1.5
Ab Initio Studies of Calcite-water Interactions. Dorothy Duffy, Jennifer Lardge and Mike Gillan; London Centre for Nanotechnology, UCL, London, United Kingdom.

10:00 AM BREAK

10:30 AM *Y1.6
Density Functional Theory Calculations and Molecular Dynamics Simulations of the Interaction of Bio-molecules with Surfaces of Hydroxyapatite in an Aqueous Environment. Nora H de Leeuw1,2 and Neyvis Almora Barrios1; 1Chemistry, University College London, London, United Kingdom; 2Institute of Orthopaedics & Musculoskeletal Science, University College London, London, United Kingdom.

11:00 AM Y1.7
Probing the Organic-Mineral Interface at the Molecular Level in Model Biominerals. Rebecca Ann Metzler1, Il Won Kim2, Katya Delak2, John S Evans2, Dong Zhou1, Elia Beniash3, Fred Wilt4, Christopher E Killian4, Mike Abrecht5, Jinghua Guo6, Susan N Coppersmith1 and Pupa Gilbert1; 1Physics, University of Wisconsin at Madison, Madison, Wisconsin; 2Center for Biomolecular Materials Spectroscopy, Laboratory for Chemical Physics, New York University, New York, New York; 3Biomineralization, The Forsyth Institute, Boston, Massachusetts; 4Molecular and Cell Biology, University of California- Berkeley, Berkeley, California; 5Synchrotron Radiation Center, Stoughton, Wisconsin; 6Advanced Light Source, Berkeley, California.

11:15 AM Y1.8
Energetics of Vacancies and Protons in Hydroxyapatite from First Principles. Katsuyuki Matsunaga, Dept. of Materials Science and Engineering, Kyoto University, Kyoto, Japan.

11:30 AM Y1.9
Nanoscopic Observation of the Effect of NaCl and NaF on Hydroxyapatite Dissolution Studied by Atomic Force Microscopy. Ki-Young Kwon1, Eddie Wang2 and Seung-Wuk Lee1,2; 1Physical Biosciences Division, Lawrence Berkeley National Laboratory, Berkeley, California; 2Bioengineering, UC Berkeley, Berkeley, California.

11:45 AM Y1.10
Ab Initio Calculations on Substituted Hydroxyapatite Systems: The Combined Role of Advanced Solid State NMR Techniques and DFT. Christian Bonhomme1, Christel Gervais1, Florence Babonneau1, Satoshi Hayakawa2 and Akiyoshi Osaka2; 1universite P et M Curie, Paris, France; 2Biomaterials laboratory, Graduate school of national science and technology, Okayama, Japan.

SESSION Y2: Biomolecules on surfaces
Chairs: Mehmet Sarikaya and Tiffany Walsh
Monday Afternoon, December 1, 2008
Berkeley A/B (Sheraton)

1:30 PM *Y2.1
Genetically-Selected Solid-Binding Peptides: Molecular-Structure, -Recognition, -Binding, -Assembly, and -Function Mehmet Sarikaya, John S Evans, Ram Samudrala, Beth Traxler and Candan Tamerler; GEMSEC, Materials Science and Engineering, University of Washington, Seattle, Washington.

2:00 PM Y2.2
Peptide Binding to Metal, Bimetal, and Sheet Silicate Even Surfaces. Hendrik Heinz1, Pratyush Dayal1, Ras B Pandey2, Jian-jie Liang3, Joseph M Slocik4, Lawrence F Drummy4, Peter A Mirau4, Ruth Pachter4, Rajesh R Naik4 and Barry L Farmer4; 1Department of Polymer Engineering, University of Akron, Akron, Ohio; 2Department of Physics and Astronomy, University of Southern Mississippi, Hattiesburg, Mississippi; 3Accelrys, Inc., San Diego, California; 4Materials and Manufacturing Directorate, Air Force Research Laboratory, Wright-Patterson AFB, Ohio.

2:15 PM Y2.3
Molecular Simulations of the Interactions between Strong-Binding Peptides and Quartz Surfaces. Rebecca Notman and Tiffany R Walsh; Department of Chemistry and Centre for Scientific Computing, University of Warwick, Coventry, United Kingdom.

2:30 PM Y2.4
A Knowledge-based Quest for Amelogenin Function in Enamel Biomineralization. Ersin Emre Oren1,2, Mustafa Gungormus1, Ram Samudrala2, Jeremy A Horst2, Hanson Fong1, Marketa Hnilova1, John S. Evans3, Malcolm L. Snead4, Martha Somerman5, Candan Tamerler1,6 and Mehmet Sarikaya1; 1GEMSEC, Materials Science and Engineering Department, University of Washington, Seattle, Washington; 2Computational Biology Research Group, Department of Microbiology, University of Washington, Seattle, Washington; 3Laboratory for Chemical Physics, New York University, New York, New York; 4School of Dentistry, University of Southern California, Los Angeles, California; 5School of Dentistry, University of Washington, Seattle, Washington; 6Molecular Biology and Genetics, Istanbul Technical University, Istanbul, Turkey.

2:45 PM Y2.5
Directed Laboratory Evolution of Biomineralizing Enzymes. Lukmaan A. Bawazer1,2,3, Michi Izumi2, Dmitriy Kolodin4, Birgit Schwenzer5 and Daniel E Morse2,3,4; 1Biomolecular Science and Engineering Interdepartmental Program, University of California, Santa Barbara, California; 2Institute for Collaborative Biotechnologies, University of California, Santa Barbara, California; 3Materials Research Laboratory, University of California, Santa Barbara, California; 4Department of Molecular, Cellular and Developmental Biology, University of California, Santa Barbara, California; 5California NanoSystems Institute, University of California, Santa Barbara, California.

3:00 PM BREAK

3:30 PM *Y2.6
Modelling Binding Affinity at Peptide-surface Interfaces: the Role of Mutations. Tiff Walsh, Adam Skelton, Rebecca Notman, Susana Tomasio and Taining Liang; Chemistry and Centre for Scientific Computing, University of Warwick, Coventry, United Kingdom.

4:00 PM Y2.7
Genetically Tailored Peptides for Bionanotechnology. Candan Tamerler1,2 and Mehmet Sarikaya2; 1Molecular Biology and Genetics, Istanbul Technical University, Istanbul, Turkey; 2Materials Science and Engineering, University of Washington, Seattle, Washington.

4:15 PM Y2.8
Adsorption of Peptide Chains (CR31, S2) on a Clay Surface by a Coarse-grained Monte Carlo Simulation. Ras B. Pandey1, Hendrik Heinz2, Lawrence F Drummy3, Richard A Vaia3, Rajesh R Naik3 and Barry L Farmer3; 1Physics and Astronomy, University of Southern Mississippi, Hattiesburg, Mississippi; 2Polymer Engineering, University of Akron, Akron, Ohio; 3Materials and Manufacturing Directorate, Air Force Research Laboratory, Dayton, Ohio.

4:30 PM Y2.9
Single Wall Carbon Nanotube-Peptide Hybrid for the Detection of TNT: Simulation and Experiments. Zhifeng Kuang, Sang Nyon Kim, Wendy J Crookes-Goodson, Barry L Farmer and Rajesh R Naik; Materials and Manufacturing Directorate, Air Force Research Laboratory, Wright-Patterson AFB, Ohio.

4:45 PM Y2.10
Self-Assembled Oligopeptides on the Au(111) Surface: a Molecular Dynamics Study of the Peptide-Surface Adhesion and Detachment Mechanisms in Water. Stefano Corni1 and Susanna Monti2; 1INFM-CNR National Research Center S3, Modena, Italy; 2IPCF-CNR, Pisa, Italy.

SESSION Y3: Poster Session
Monday Evening, December 1, 2008
8:00 PM
Exhibition Hall D (Hynes)

Y3.1
Coexistence of Calcite and Amorphous Calcium Carbonate(ACC) in Acid Polysaccharide-mediated Biomimetic CaCO3 Spherulites. Chao Zhong1 and C. C Chu1,2; 1Fiber science program, Cornell University, Ithaca, New York; 2Biomedical Engineering Program, Cornell University, Ithaca, New York.

Y3.2
Molecular Dynamics Simulations of Peptides on Calcite Surfaces. Mingjun Yang1, Mark Rodger2 and John Harding3; 1NanoScience Center, University of Copenhagen, Copenhagen, Denmark; 2Department of Chemistry, University of Warwick, Coventry, United Kingdom; 3Department of Engineering Materials, University of Sheffield, Sheffield, United Kingdom.

Y3.3
Models for the Nucleation and Growth of Calcium Carbonate. John Harding1, Colin L Freeman1, Mingjun Yang2, James Elliott3, Dorothy M Duffy5, Jennifer Lardge5, David J Cooke4, David Quigley6 and P. M Rodger6; 1Engineering Materials, Univ. of Sheffield, Sheffield, United Kingdom; 2Nano-Science Center, University of Copenhagen, Copenhagen, Denmark; 3Dept. of Materials, University of Cambridge, Cambridge, United Kingdom; 4School of Applied Sciences, University of Huddersfield, Huddersfield, United Kingdom; 5Dept. of Physics and Astronomy, University College London, London, United Kingdom; 6Dept. of Chemistry, University of Warwick, Coventry, United Kingdom.

Y3.4
Abstract Withdrawn

Y3.5
Abstract Withdrawn

Y3.6
The Role of Molecular Monolayers in Biomineralisation. Colin Freeman1, John H Harding1 and David Cooke2; 1Engineering Materials, University of Sheffield, Sheffield, United Kingdom; 2School of Applied Sciences, University of Huddersfield, Huddersfield, United Kingdom.

Y3.7
Development of Nano- and Micro-structured Calcium Phosphate Composites. Deng (Debra) Lin, Hiroaki Sai, Kunjal Patel, Chris Sarra, Ulrich Wiesner and Lara Estroff; Materials Science & Engineering, Cornell University, Ithaca, New York.

Y3.8
Morphological and Kinetic Transformation of Calcium Carbonate Crystal Growth by Water-Soluble Synthetic Polymers. Raehyun Kim1, Sang-soo Lee1 and Il Won Kim2 and Junkyung Kim1; 1Hybrid Materials Research Center, Korea Institute of Science and Technology, Seoul, South Korea; 2Chemical & Environmental Engineering, Soongsil University, Seoul, South Korea.

Y3.9
Monomer Adsorption, Cluster Mobility, and Self-Assembly of Inorganic Binding Peptides on Solid Surfaces. Christopher R So1, Hakim Meskine3, Candan Tamerler2, Paul Mulheran3 and Mehmet Sarikaya1; 1Materials Science and Engineering, GEMSEC, University of Washington, Seattle, Washington; 2Molecular Biology, Istanbul Technical University, Istanbul, Turkey; 3Chemical Engineering, University of Strathclyde, Glasgow, United Kingdom.

SESSION Y4: Mesocrystals and Aggregation
Chairs: Amanda Barnard and Kiyotaka Shiba
Tuesday Morning, December 2, 2008
Berkeley A/B (Sheraton)

8:30 AM *Y4.1
Biomineralization Studies Using Motif-Programmed Artificial Proteins. Kiyotaka Shiba, Protein Engineering, Cancer Institute, Tokyo, Japan.

9:00 AM Y4.2
Dynamics of Peptide Self-assembly at Interfaces. Lorraine Leon1, Phillip Logrippo2 and Raymond S Tu1; 1Chemical Engineering, The City College of New York - CUNY, New York, New York; 2Chemical engineering, Manhattan College, New York, New York.

9:15 AM Y4.3
Phase Behavior of Surface-adsorbed Polymers Studied by Lattice Chain Modeling: Implications for Biomineralization. James Elliott and Dmytro Antypov; Department of Materials Science and Metallurgy, University of Cambridge, Cambridge, CB2 3QZ, United Kingdom.

9:30 AM Y4.4
SP1, A Switchable Silicon Oxide Binding Protein Scaffold for Nano-Fabrication. Arnon Heyman1, Izhar Medalsy2, Oron Bet Or1, Or Dgany1, Danny Porath2 and Oded Shoseyov1; 1The Robert H. Smith Institute of Plant Sciences and Genetics in Agriculture Faculty of Agricultural, Food and Environmental Quality Sciences, The Hebrew University of Jerusalem, Rehovot, Israel; 2Physical Chemistry Department, The Hebrew University of Jerusalem, Jerusalem, Israel.

9:45 AM Y4.5
Comparative Effects of Self-assembled Noncollageneous Extracellular Proteins on Biomineralization in Vitro. Xiaolan Ba1, Yizhi Meng2, Elaine DiMasi3, Helga Füredi-Milhofer4, Yi-Xian Qin2, Nadine Pernodet1 and Miriam Rafailovich1; 1Materials Sciences and Engineering, SUNY-Stony Brook, Stony Brook, New York; 2Biomedical Engineering, SUNY-Stony Brook, Stony Brook, New York; 3National Synchrotron Light Source, Brookhaven National Laboratory, Upton, New York; 4The Hebrew University, Jerusalem, Israel.

10:00 AM BREAK

10:30 AM *Y4.6
Modeling the Shape of Nanoscale Iron Sulphides Formed During Biomineralization. Amanda S Barnard1 and Salvy P Russo2; 1School of Chemistry, University of Melbourne, Melbourne, Victoria, Australia; 2Applied Physics, School of Applied Sciences, RMIT University, Melbourne, Victoria, Australia.

11:00 AM Y4.7
Doping Magnetosomes with Mn, Co and Ru: Effects on Morphology, Chemical Composition, and Magnetic Properties. Tanya Prozorov1, Ruslan Prozorov1,2, Surya K. Mallapragada1,3, Teresa Perez-Gonzalez4, Concepcion Jimenez-Lopez4 and Dennis Bazylinski5; 1Materials Chemistry and Biomolecular Materials, Ames Laboratory, Ames, Iowa; 2Physics and Astronomy, Iowa State University, Ames, Iowa; 3Chemical and Biological Engineering, Iowa State University, Ames, Iowa; 4Microbiology, University of Granada, Granada, Spain; 5School of Life Sciences, University of Nevada, Las Vegas, Nevada.

11:15 AM Y4.8
Understanding the Plate-Shaped Morphology of Hydroxyapatite Crystals and Implications to the Structure of the Bone. B. Viswanath and Ravishankar Narayanan; Materials Research Centre, Indian Institute of Science, Bangalore, India.

11:30 AM Y4.9
Molecular-scale Model for Predicting Crystal Growth Morphology: A First Principles Approach. Manoj Kumar Singh1 and Arup Banerjee2; 1Laser Materials Development and Devices Division, Raja Ramanna Centre For Advanced Technology, Indore, M.P., India; 2Laser Physics Applications Division, Raja Ramanna Centre for Advanced Technology, Indore, India, Indore, M.P., India.

11:45 AM Y4.10
Formation of CaCO3 Microspheres from Urease-Immobilized Substrates. Bongjun Yeom and Kookheon Char; Seoul National University, Seoul, South Korea.

SESSION Y5: Biomimetics and Biomineralization
Chair: John Evans
Tuesday Afternoon, December 2, 2008
Berkeley A/B (Sheraton)

1:30 PM *Y5.1
New Functional Ceramic Composits through Biomineralization? Monika Fritz, Pure and Applied Biomineralisation, Biophysics Institute, University Bremen, Bremen, Germany.

2:00 PM Y5.2
Biomineralisation of Calcite with Ovocledin-17: The Chicken and the Egg. Colin Freeman1, John H Harding1, David Quigley2 and Mark Rodger2; 1Engineering Materials, University of Sheffield, Sheffield, United Kingdom; 2Chemistry, University of Warwick, Coventry, United Kingdom.

2:15 PM Y5.3
Micro-beam SAXS/WAXS Study of the Nano-Structure in Biogenic Calcite. Christoph Gilow1, Barbara Aichmayer1, Oskar Paris1, Frédéric Marin2, Emil Zolotoyabko3 and Peter Fratzl1; 1Department of Biomaterials, Max-Planck Institute of Colloids and Interfaces, Potsdam, Germany; 2Laboratoire de Biogéosciences, UMR 5561, Université de Bourgogne, Dijon, France; 3Department of Materials Engineering, Technion - Israel Institute of Technology, Haifa, Israel.

2:30 PM Y5.4
Effect of Self-Assembled Porcine Amelogenins on Calcium Phosphate Formation in Vitro. Seo-Young Kwak1, Felicitas B Wiedemann-Bidlack1, Elia Beniash3, Yasuo Yamakoshi2, James P Simmer2 and Henry C Margolis1; 1Biomineralization, The Forsyth Institute, Boston, Massachusetts; 2Dental Research Laboratory, University of Michigan, Ann Arbor, Michigan; 3Department of Oral Biology, University of Pittsburgh, Pittsburgh, Pennsylvania.

2:45 PM Y5.5
Analysis of the Microstructure of the Coral Skeleton of Porites Lutea with Respect to the Coral Growth Mechanism. Roland Kroeger1, Tim Rixen2, Christian Kübel3 and Eunah Lee4; 1Department of Physics, University of York, York, United Kingdom; 2Center for Tropical Marine Ecology, Bremen, Germany; 3Fraunhofer Institute for Manufacturing Technology and Applied Materials Research, Bremen, Germany; 4Horiba Jobin-Yvon Inc, Edison, New Jersey.

3:00 PM BREAK

3:30 PM *Y5.6
Directed Assembly in Charged Systems. Murugappan Muthukumar, University of Massachusetts, Amherst, Massachusetts.

4:00 PM Y5.7
Room-temperature Synthesis of Highly Crystalline Oxide Semiconductors on Enzymatic Templates: Urease as a Biocatalytic Nanoreactor for the Growth of ZnO Nanoshells. Roberto de la Rica and Hiroshi Matsui; Chemistry and Biochemistry, City University of New York-Hunter College, New York, New York.

4:15 PM Y5.8
The Formation of a Thin Uniform Calcium-phosphate Layer on Alumina and Zirconia Ceramics by Biomimetic Method. Irena Pribosic, Tomaz Kosmac and Sabina Beranic-Klopcic; Engineering Ceramics, Jozef Stefan Institute, Ljubljana, Slovenia.



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