All Stories

  1. A comparative study of polyethylene oxide (PEO) using different coarse-graining methods

    Article • The Journal of Chemical Physics, June 2024, American Institute of Physics

    Armand Soldera

  2. Rational Design of a Highly Potent and Selective Peptide Inhibitor of PACE4 by Salt Bridge Interaction with D160 at Position P3

    Article • ChemMedChem, July 2017, Wiley

    Armand Soldera

  3. Simulation of Small Molecules Permeation Through Polymer Matrix

    Article • Journal of Molecular and Engineering Materials, December 2016, World Scientific Pub Co Pte Lt

    Armand Soldera

  4. Unveiling the impact of regioisomerism defects in the glass transition temperature of PVDF by the mean of the activation energy

    Article • Journal of Polymer Science Part A Polymer Chemistry, November 2016, Wiley

    Armand Soldera

  5. Unraveling the interplay between hydrogen bonding and rotational energy barrier to fine-tune the properties of triazine molecular glasses

    Article • Physical Chemistry Chemical Physics, January 2016, Royal Society of Chemistry

    Armand Soldera

  6. ChemInform Abstract: Regio- and Stereoselective Synthesis of Spiropyrrolizidines and Piperazines Through Azomethine Ylide Cycloaddition Reaction.

    Article • ChemInform, January 2016, Wiley

    Armand Soldera

  7. Heterogeneous character of supercritical water at 400 °C and different densities unveiled by simulation

    Article • RSC Advances, January 2016, Royal Society of Chemistry

    Armand Soldera

  8. Regio- and Stereoselective Synthesis of Spiropyrrolizidines and Piperazines through Azomethine Ylide Cycloaddition Reaction

    Article • The Journal of Organic Chemistry, September 2015, American Chemical Society (ACS)

    Armand Soldera

  9. ChemInform Abstract: Synthesis of Novel Dispiropyrrolothiazoles by Three-Component 1,3-Dipolar Cycloaddition and Evaluation of Their Antimycobacterial Activity.

    Article • ChemInform, April 2015, Wiley

    Armand Soldera

  10. A strategic approach to the synthesis of functionalized spirooxindole pyrrolidine derivatives: in vitro antibacterial, antifungal, antimalarial and antitubercular studies

    Article • New Journal of Chemistry, January 2015, Royal Society of Chemistry

    Dr Dhanji Popatbhai Rajani, Armand Soldera, moheddine askri

  11. A new comonomer design for enhancing the pH-triggered LCST shift of thermosensitive polymers

    Article • Polymer Chemistry, January 2015, Royal Society of Chemistry

    Armand Soldera

  12. Molecular Simulation of Fluoropolymers

    Article • May 2014, Wiley

    Armand Soldera

  13. Structure and dynamics of water confined in a polyamide reverse-osmosis membrane: A molecular-simulation study

    Article • Journal of Membrane Science, May 2014, Elsevier

    Armand Soldera

  14. Inside Cover: Supramolecular Complexes of Multivalent Cholesterol-Containing Polymers to Solubilize Carbon Nanotubes in Apolar Organic Solvents (Chem. Asian J. 5/2014)

    Article • Chemistry - An Asian Journal, April 2014, Wiley

    Professor Jerome P Claverie, Armand Soldera

  15. New Insights into the Thermal Stability of the Smectic C Phase

    Article • The Journal of Physical Chemistry B, April 2014, American Chemical Society (ACS)

    Armand Soldera

  16. Supramolecular Complexes of Multivalent Cholesterol-Containing Polymers to Solubilize Carbon Nanotubes in Apolar Organic Solvents

    Article • Chemistry - An Asian Journal, March 2014, Wiley

    Professor Jerome P Claverie, Armand Soldera

  17. 7. Theoretical tools for designing microscopic to macroscopic properties of functional materials

    Article • January 2014, De Gruyter

    Armand Soldera

  18. Synthesis of novel dispiropyrrolothiazoles by three-component 1,3-dipolar cycloaddition and evaluation of their antimycobacterial activity

    Article • RSC Advances, January 2014, Royal Society of Chemistry

    Armand Soldera, moheddine askri

  19. Luminescent P-Chirogenic Copper Clusters

    Article • Inorganic Chemistry, July 2013, American Chemical Society (ACS)

    Armand Soldera

  20. Change in morphology of fuel cell membranes under shearing

    Article • Soft Matter, January 2013, Royal Society of Chemistry

    Armand Soldera

  21. Heads vs. tails: a double-sided study of the influence of substituents on the glass-forming ability and stability of aminotriazine molecular glasses

    Article • New Journal of Chemistry, January 2013, Royal Society of Chemistry

    Armand Soldera

  22. Functionalization of molecular glasses: effect on the glass transition temperature

    Article • Journal of Materials Chemistry C, January 2013, Royal Society of Chemistry

    Armand Soldera

  23. The importance of the amide configuration in the gelation process and topochemical polymerization of phenylacetylene macrocycles

    Article • Journal of Materials Chemistry C, January 2013, Royal Society of Chemistry

    Armand Soldera

  24. One ring to rule them all: effect of aryl substitution on glass-forming ability in mexylaminotriazine molecular glasses

    Article • Tetrahedron, December 2012, Elsevier

    Armand Soldera

  25. Atomistic simulations of vinyl polymers

    Article • Molecular Simulation, July 2012, Taylor & Francis

    Armand Soldera

  26. Molecular modeling assisted design of new monomers utilized in fuel cell proton exchange membranes

    Article • Journal of Membrane Science, May 2012, Elsevier

    Armand Soldera

  27. Theoretical Design of the Molecular Structure of Bent-Core Mesogens with Large Second-Order Nonlinear Optical Properties.

    Article • The Journal of Physical Chemistry C, April 2012, American Chemical Society (ACS)

    Armand Soldera

  28. Characterization of the telomerization reaction path for vinylidene fluoride with ĊCl3radicals

    Article • Polymer Chemistry, January 2012, Royal Society of Chemistry

    Armand Soldera

  29. Melting of polymernanocrystals: a comparison between experiments and simulation

    Article • Soft Matter, January 2012, Royal Society of Chemistry

    Professor Jerome P Claverie, Armand Soldera

  30. Molecular Dynamics Simulation of the SmC Phase

    Article • Ferroelectrics, January 2012, Taylor & Francis

    Armand Soldera

  31. Simulated infrared spectra of triflic acid during proton dissociation

    Article • Journal of Computational Chemistry, January 2012, Wiley

    Armand Soldera

  32. Teaching Polymer Chemistry: Revisiting the Syllabus

    Article • Open Journal of Polymer Chemistry, January 2012, Scientific Research Publishing, Inc,

    Armand Soldera

  33. Investigation of the Relationship Between the Molecular Structure and the Thermal Stabilization of the Smectic C Phase in Four Series of Calamitic Smectogens

    Article • Ferroelectrics, January 2012, Taylor & Francis

    Armand Soldera

  34. Synthesis and characterization of a new ethynyl-bridged C60 derivative bearing a diketopyrrolopyrrole moiety

    Article • Tetrahedron Letters, September 2011, Elsevier

    Armand Soldera

  35. Macromol. Theory Simul. 4/2011

    Article • Macromolecular Theory and Simulations, May 2011, Wiley

    Armand Soldera

  36. Effect of the Molar Volume on the Elastic Properties of Vinylic Polymers: A Static Molecular Modeling Approach

    Article • Macromolecular Theory and Simulations, March 2011, Wiley

    Armand Soldera

  37. Ethynyl-bridged fullerene derivatives: effect of the secondary group on electronic properties

    Article • New Journal of Chemistry, January 2011, Royal Society of Chemistry

    Armand Soldera

  38. Heat capacities of both PMMA stereomers: Comparison between atomistic simulation and experimental data

    Article • Polymer, April 2010, Elsevier

    Armand Soldera

  39. Phase transition and morphology of polydispersed ABA′ triblock copolymers determined by continuous and discrete simulations

    Article • The Journal of Chemical Physics, February 2009, American Institute of Physics

    Armand Soldera

  40. Study of the influence of ester orientation on the thermal stability of the smectic C phase: Simulation investigation

    Article • The Journal of Chemical Physics, October 2008, American Institute of Physics

    Armand Soldera

  41. Study of the influence of ester orientation on the thermal stability of the smectic C phase: experimental investigation

    Article • Liquid Crystals, March 2008, Taylor & Francis

    Armand Soldera

  42. Multi-scale Approach to the Design of Ferroelectric Liquid Crystals for NLO Applications

    Article • January 2008, American Institute of Physics

    Armand Soldera

  43. The Vogel−Fulcher−Tamman Equation Investigated by Atomistic Simulation with Regard to the Adam−Gibbs Model

    Article • Macromolecules, December 2007, American Chemical Society (ACS)

    Armand Soldera

  44. Generation, Characterization, and Electrochemical Behavior of the Palladium–Hydride Cluster [Pd3(dppm)3(μ3-CO)(μ3-H)]+ (dppm=Bis(diphenylphosphinomethane)

    Article • Chemistry - A European Journal, June 2007, Wiley

    Armand Soldera

  45. Theoretical design of sulfinate-based ferroelectric liquid crystals displaying second-order nonlinear optical properties

    Article • Chemical Physics Letters, May 2007, Elsevier

    Armand Soldera

  46. Glass transition of polymers: Atomistic simulation versus experiments

    Article • Physical Review E, December 2006, American Physical Society (APS)

    Armand Soldera

  47. Unexpected Reaction of the Unsaturated Cluster Host and Catalyst [Pd3(μ3-CO)(dppm)3]2+ with the Hydroxide Ion: Spectroscopic and Kinetic Evidence of an Inner-Sphere Mechanism

    Article • Chemistry - A European Journal, November 2006, Wiley

    Armand Soldera

  48. How Can Azobenzene Block Copolymer Vesicles Be Dissociated and Reformed by Light?

    Article • The Journal of Physical Chemistry B, November 2005, American Chemical Society (ACS)

    Armand Soldera

  49. Liquid crystal molecules with an enyne rigid core

    Article • Liquid Crystals, October 2005, Taylor & Francis

    Armand Soldera

  50. Glass transition phenomena observed in stereoregular PMMAs using molecular modeling

    Article • Composites Part A Applied Science and Manufacturing, April 2005, Elsevier

    Armand Soldera

  51. Cooperativity in stereoregular PMMAs observed by molecular simulation

    Article • Polymer, February 2004, Elsevier

    Armand Soldera

  52. Towards a new class of ferroelectric liquid crystal molecules for nonlinear optical applications

    Article • Liquid Crystals, October 2003, Taylor & Francis

    Armand Soldera

  53. Energetic analysis of the two PMMA chain tacticities and PMA through molecular dynamics simulations

    Article • Polymer, July 2002, Elsevier

    Armand Soldera

  54. Molecular modeling of the glass transition of stereoregular PMMAs

    Article • Polymer-Plastics Technology and Engineering, June 2002, Taylor & Francis

    Armand Soldera

  55. Local Dynamics of Stereoregular PMMAs Using Molecular Simulation

    Article • Macromolecules, January 2002, American Chemical Society (ACS)

    Armand Soldera

  56. Tacticity induced molecular microstructure dependence of the configurational properties of metallocene-synthesized polypropylenes

    Article • European Polymer Journal, June 2001, Elsevier

    Armand Soldera

  57. MOLECULAR MODELING OF POLYMER-CHAIN TACTICITY

    Article • Polymer-Plastics Technology and Engineering, May 2000, Taylor & Francis

    Armand Soldera

  58. Determination of the polymer tacticity from calculation of infrared spectra based on classical molecular simulations

    Article • Macromolecular Symposia, August 1998, Wiley

    Armand Soldera

  59. Comparison between the glass transition temperatures of the two PMMA tacticities: A molecular dynamics simulation point of view

    Article • Macromolecular Symposia, August 1998, Wiley

    Armand Soldera

  60. Infrared absorption spectra of polymers from classical molecular simulation

    Article • Macromolecular Symposia, July 1997, Wiley

    Armand Soldera

  61. Epitaxial Crystallization in Mixtures of Optically Active Polyesters

    Article • Macromolecules, May 1997, American Chemical Society (ACS)

    Armand Soldera

  62. Pyridinium salt liquid crystals Effect of mesogen extension and alkyl chain length

    Article • Liquid Crystals, March 1995, Taylor & Francis

    Armand Soldera

  63. Ferroelectric Liquid Crystals with a Tolane Rigid Core and an Optically Active Alkyl Sulfinate Group: Synthesis, Characterization, Molecular Modeling, and Stereochemical Investigations

    Article • Chemistry of Materials, May 1994, American Chemical Society (ACS)

    Armand Soldera

  64. Synthesis and properties of new ferroelectric liquid-crystalline compounds having a tolane rigid core and an optically active alkyl sulphinate group

    Article • Liquid Crystals, August 1992, Taylor & Francis

    Armand Soldera

  65. Acetylenic and diacetylenic liquid-crystalline monomers: towards ordered conjugated polymers

    Article • Liquid Crystals, January 1989, Taylor & Francis

    Armand Soldera

  66. Chapter 11. Molecular Simulation of Fluorinated Telomer and Polymers

    Article • Royal Society of Chemistry

    Armand Soldera