Day 2 :
Keynote Forum
Benny Danilo Belviso
Institute of Crystallography (CNR), Italy
Keynote: Advanced materials to make easier protein crystallization
Time : 10:00-10:45
Biography:
Abstract:
Keynote Forum
Ramin Zibaseresht
Maritime University of Imam Khomeini, Iran
Keynote: Synthesis, structural analysis and antibacterial effect of a novel heteronuclear Ag(I)-Fe(II) coordination polymer
Time : 11:00-11:45
Biography:
Abstract:
- Crystallography in Material Science | Role of Polymers in Biological Systems | Novel Materials for Energy Applications | Chemical Crystallography | Advanced Technologies in Polymer Synthesis
Location: Bucharest, Romania
Chair
Oara Neumann
Rice University Applied Physics, USA
Co-Chair
Benny Danilo Belviso
Institute of Crystallography (CNR), Italy
Session Introduction
Uwe Popp
Apium Additive Technologies GmbH, Germany
Title: Mechanical properties of heat treated 3D printed semi-crystalline PEEK material
Time : 13:45-14:15
Biography:
Abstract:
Oara Neumann
Rice University Applied Physics, USA
Title: Enhanced T1 MRI contrast and fluorescence stability within a plasmonic core-shell nanoparticle
Time : 14:15-14:45
Biography:
Oara Neumann has completed her PhD and Postdoctoral study in Applied Physics from Rice University and MS from Weizmann Institute of Science, Israel and Bucharest University, Romania. She is a Research Scientist in Naomi Halas group at Rice University. She holds 12 patents and she has published more than 25 papers in reputed journals.
Abstract:
Mariana Costa
Instituto Politécnico do Cávado e do Ave – IPCA, Portugal
Title: Synthesis of novel autoreactive and ecological mono-component adhesives for the shoe industry
Time : 14:45-15:15
Biography:
Mariana Costa has a Master's Degree in Chemical Engineering and she is currently working in Polytechnic Institute of Cavado and Ave. The project that she is involved is about the microencapsulation field where the goal is to produce a microfluidic device to encapsulate isocyanate.
Abstract:
Zafar Iqbal
Pakistan Institute of Engineering and Applied Sciences (PIEAS), Pakistan
Title: Microstructural evolution of nanocrystalline tungsten-25% Rhenium-Hafnium carbide composite synthesized by spark plasma sintering technique for FSW tool application
Time : 15:30-16:00
Biography:
Abstract:
Anca DUTA
Transilvania University of Brasov, Romania
Title: Composite nanostructures for VIS-active photocatalysts
Time : 16:00-16:30
Biography:
Abstract:
Rodica VLADOIU
Ovidius University of Constanta, Romania
Title: Synthesis and characterization of the complex nanostructured thin films based on titanium by Thermionic Vacuum Arc (TVA) method
Time : 16:30-17:00
Biography:
VLADOIU Rodica has completed his PhD at the age of 35 years from Bucharest University Romania. She was Head of the Physics Department between 20042006, Local Coordinator of the CEEPUS network from 2000, Member in the National University Research Council – CNCSIS in 2006, Member in the Scientific Commitee in International conference II CESPC Central European Symposium on Plasma Chemistry 2008, Brno, Czech Republic. She is co-author in 78 papers published in reviews with ISI quotation (428 citations) and in 2 national patents.In the last ten years, she was involved with the research team in 11 National Research projects and 9 International projects.
Abstract:
Asma Khurshid
Pakistan Institute of Engineering and Applied Sciences, Pakistan
Title: A close insight into the nature of intra and intermolecular interactions in 1-acyl thioureas and dihydropyrimidine-2-(1H) thione derivatives using single crystal X-ray crystallography and related techniques
Time : 17:00-17:20
Biography:
Dr. Asma Khurshid has completed her PhD Chemistry in 2017 from Quaid-i-Azam University, Pakistan. Part of her PhD research has been carried out at Oxford University; United Kingdom. Up till now she has 7 publications on her part in Journals of International repute. She has been selected as Young Scientist among global competition for participation in 67th Chemistry Lindau Nobel Laureates Meeting in Chemistry, Germany 2017. Presently, she is serving as Assistant Professor in Department of Chemistry, Pakistan Institute of Engineering & Applied Sciences, Pakistan.
Abstract:
Single crystal X-ray crystallographic studies has been carried out in order to explore the nature of intra- and inter molecular interaction in 1-(4-chlorobenzoyl)-3-(2-methyl-4-oxopentan-2-yl) thiourea, 1-(2-chlorobenzoyl)thiourea and for the following derivatives of 1-(R-phenyl)-4,4,6-trimethyl-3,4-dihydropyrimidine-2(1H)-thione i.e., R = 2-chloro (1), 2,3-di-chloro (2), 2,4-di-methyl (3), and 4-methoxy (4). This study has also been supported by vibrational analysis (FT-IR, FT-Raman) in addition to Topological and Hirshfield surface analysis which give a visual three-dimensional picture of the nature of intermolecular interactions in case of the newly synthesized dihydropyrimidine-2-(1H) thione derivatives.
The synthesis of 1-(4-chlorobenzoyl)-3-(2-methyl-4-oxopentan-2-yl) thiourea was carried out with particular focus to investigate the effect exerted by competing intramolecular C=O….H-N bonds in the molecular structure. The molecular and X-ray crystal analysis of this compound revealed the preferential existence of S conformer over U conformer with the C=O and C=S bonds pointing in opposite directions.The application of vibrational analysis in addition to crystal studies for the newly synthesized 1-(2-chlorobenzoyl)thiourea indicated the presence of extended N–H….S=C hydrogen-bonding networks between both the carbamide (NH2) and thioamide (N–H) groups and the thiocarbonyl bond (C=S) that are significant for crystal packing in its structure.The detailed crystal structure analysis revealed that the four studied dihydropyrimidine-2-(1H)-thione derivatives attain the following canonical conformations: (1) 2S1 screw-boat form; (2) E2 envelope; (3) Intermediate between 6S1 screw-boat and 6H1 half-chair form; (4) E4 envelope. While the topological analysis of the electron densities highlights the importance of dominant N-H…S interactions for stabilization of crystal packing in all four derivatives studied.
Sandeep Kulkarni
KoolEarth Solutions Inc., USA
Title: The best of times – How sustainability commitments by global corporations are fueling development and commercialization of bioplastics
Time : 17:20-17:40
Biography:
Sandeep Kulkarni has completed his PhD from Rensselaer Polytechnic Institute, Troy, New York, USA and Postdoctoral studies from University of Massachusetts, Amherst. He has over 20 years of industry experience in the consumer packaging field, including 8 years at PepsiCo. He is currently the Founder and President of KoolEarth Solutions Inc., a consulting company in the area of sustainable packaging. He has several patents, publications and international presentations.
Abstract:
In the face of unprecedented environmental challenges and issues (such as plastic pollution/litter and climate change) global governments, non-governmental orgainization and corporations are coming together to formulate apporoaches for tackling these challenges. Large Consumer Packaged Goods (CPG) companies such as PepsiCo, Unilever, Starbucks and McDonald’s have announced bold and aggressive goals related to the end-of-life for their packaging materials. These include commitments to make their packaging fully recylable, compostable/biodegradable and to reduce the Greenhouse Gas (GHG) impacts from their packaging. Biodegradable bioplastics (such as PLA and PHAs) can provide a viable solution for hard-to-recycle packaging (such as multilayer pouches/satches) and also in potentially addressing litter issues on land or in the ocean. Also, non-biodegradable bioplastics (such as bio-PET and PEF) can help reduce GHG impacts of packaging while being fully recyclable. For the above reasons, there have been significant investments in bioplastics research and development, both in small as well as large companies globally. This presentation will highlight some of these efforts and provide an insight into the future commercial applications of bioplastics. Examples of potential future commercial applications include PHA based compostable/biodegradable snack packaging (being developed by PepsiCo), as well as recyclable and biodegradable single-use cups (being developed by Starbucks/McDonald’s).
- Crystallography of Novel Materials | Chemical Crystallography | Role of Polymers in Biological Systems | Recent Development in the X-ray Studies | Biodegradable Polymers | Biomaterials and Biopolymers
Location: Bucharest, Romania
Chair
Nimrod Israely
Biofeed Environmentally Friendly Pest Control, Israel
Co-Chair
Tasnim Kossentini Kallel
National School of Engineers of Sfax, Tunisia
Session Introduction
Nikolay PLUSNIN
FEB RAS-Institute of Automation and Control Processes, Russia
Title: Conjoint AES - EELS analysis of the subnanometric coatings
Time : 11:45-12:15
Biography:
Abstract:
Bakti Berlyanto Sedayu
Victoria University, Australia
Title: Effects of glycerol incorporation on Semi-Refined Carrageenan film properties
Time : 12:15-12:45
Biography:
Bakti B Sedayu is undertaking PhD research program in Victoria University, Australia. His project focuses on development of packaging material from seaweed.
Abstract:
Delia-Laura Popescu
University of Bucharest, Romania
Title: Structural properties and topological diversity of new ORGANOTIN(IV) cordination compounds
Time : 13:45-14:15
Biography:
Abstract:
Organotin(IV) coordination compounds have been the subject of interest for some time due to their properties, structural aspects and potential biomedical, environmental and commercial applications. A new series of coordination compounds with different organotin(IV) subunits as nodes and organic bridging ligands as spacers were prepared. The combination of organotin(IV) building blocks with O- and N-donor ligands resulted in the formation of new extended structures with 0D, 1D (an example is given in figure-1), 2D and 3D dimensionalities and interesting topologies. The influence of the nature of organotin(IV) nodes and the bridging ligands on the structural properties of the new systems obtained was investigated. All the synthesized compounds have been characterized by elemental analysis, standard spectroscopic techniques (FTIR, UV-Vis-NIR, NMR), thermal analysis, as well as by single crystal and powder X-ray diffraction. The ligands, metal precursors and their corresponding organotin(IV) complexes have also been screened for antimicrobial activities.
Tasnim Kossentini Kallel
National School of Engineers of Sfax, Tunisia
Title: Assessment of biodegradation and biological properties of modified biopolymers
Time : 14:15-14:45
Biography:
Abstract:
Ramin Zibaseresht
Maritime University of Imam Khomeini, Iran
Title: Synthesis, structural analysis and DNA interaction of Bis[4'-(4-methylphenyl)-2,2':6',2
Time : 14:45-15:15
Biography:
Abstract:
Francisco Fábio Oliveira de Sousa
Federal University of Amapa School of Pharmacy, Brazil
Title: Biopharmaceutical and functional activities improvement by drug-biopolymers association
Time : 15:15-15:45
Biography:
Abstract:
Zein is a biodegradable protein found in the maize endosperm (Zea mays). In the pharmaceutical industry, it has been used as a coating agent in solid forms and in the composition of drug delivery systems, where it has shown the ability to entrap drugs, lipids and genetic material, promoting their controlled release. Its biological potential has gained attention lately. Thus, the antioxidant and antimicrobial activities of zein solely have been identified, but barely explored. The associations of biopolymers to drugs could result in synergistic or additive effects, depending on the structure, solubility, partition coefficient and chemical interactions to the other compounds, resulting in new outcomes. In view of the biological properties of zein, we assessed the improvement in the antimicrobial and antioxidant activities of this biopolymer when associated to some phenolic bioactive, such as Ellagic Acid (EA). Their chemical association was accessed by 1H saturation Transfer-Difference Nuclear Magnetic Resonance (STD-NMR) to explain these outcomes. The micro dilution method was used to assess the minimum inhibitory and bactericide concentrations. The antioxidant activity was determined using the 2, 2-diphenyl-1-picryl-hydrazila free radical scavenging method. EA has shown inhibitory activity against Staphylococcus aureus and Pseudomonas aeruginosa and an antioxidant IC50 of 0.079 mg/mL. Zein has shown antimicrobial and antioxidant activities itself and enhanced synergically the antioxidant and the antimicrobial activity against P. aeruginosa when combined with EA. 1H STD-NMR experiment confirmed the formation of a complex between EA and zein that could be related with the improvement on its biological performance over the individual compounds.
Denis Mihaela Panaitescu
National Institute for Research & Development in Chemistry and Petrochemistry – ICECHIM, Romania
Title: Porous structures from nanocellulose and biopolymers for biomedical application
Time : 16:00-16:20
Biography:
Abstract:
Ioana Chiulan
The National Institute for Research & Development in Chemistry and Petrochemistry ICECHIM, Romania
Title: Influence of nanosilica content on the thermal and mechanical properties of liquid silicone elastomers
Time : 16:00-16:20
Biography:
Ioana Chiulan has completed his PhD in 2011, from University Politehnica of Bucharest, in the field of thermoresponsive hydrogels. He has an experience of more than 10 years as researcher and her work is focused on different materials for biomedical or packaging applications. He is co-author in more than 19 papers and one book chapter. Raluca Gabor, Cristian Nicolae, Denis Panaitescu and Adriana Frone are highly skilled researchers, specialized in thermal, mechanical and morphological characterization. Elena Radu and Sergiu Stoian are recently graduated students from University Politehnica of Bucharest
Abstract:
Silicone rubbers are one of the most important polymers, because they possess important properties, such as biocompatibility, large degree of flexibility, hydrophobicity, high gas permeability, high thermal stability, good UV and oxidative resistance. However, pure silicone rubber has poor tensile strength, which limits its practical applications. To overcome this drawback, different inorganic fillers were incorporated such as nano-SiO2, carbon nanotube, nano-Al2O3, clay and so on. The aim of this work was to obtain composites based on liquid silicone rubber and hydrophilic nanosilica (HDK N20), with good flexibility and tensile strength, as potential biomaterials for pelvic prosthesis. Nanosilica particles were selected as reinforcing filler due its extraordinary properties, such as a very high specific surface area, biocompatibility, high elastic modulus, low density and low material cost. This paper reports the impact of the filler content and sample thickness on the morphology, rheological properties, thermal behavior and tensile strengths before and after flexing tests of the silicone-nanosilica composites. The addition of the nanosilica content up to 3% conducted to a significant increase of the young modulus and the tensile strength.