List of Articles Free energy

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  1 - Quantum mechanics investigation of acid dissociation constant of carboxylic acids in aqueous solution
  M. Khaleghian Gh. R. Ghashami
• Open Access Article
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  2 - A Theoretical Study on the Aromaticity of 5-methylcytosine tautomers in the gas phase
  H. Aghaie K. Zare E. Zahedi S.R. Emamian
• Open Access Article
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  3 - Thermodynamics, Solvents effects and 1H ,13C NMR Shielding :Theoretical studies of Adamantane
  Z. Bayat M. Monajjemi
• Open Access Article
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  4 - Thermodynamic Analysis for Cationic Surfactants Binding to Bovine Serum Albumin
  Abdol-Khalegh Bordbar
• Open Access Article
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  5 - Theoretical and Structural Relationship Study of Electrochemical Properties of p- Sulfonated Calix[Slarene Macrocycles with Fullerenes as lp-Sulfonated Calliplarenesi@iCsl Supramolecular Complexes
  Avat (Armen) Taherpour Karim Zare Leila Bakhtiari
• Open Access Article
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  6 - Free Energies of Electron Transfer, Electrochemical Properties, Electron Transfer Kinetic Theoretical and Quantitative Structural Relationship Studies of Cn@X-[HbA] (HbA=Hemoglobin A; X= - and -Fumarate Crosslinked Hemoglobins (XL & XL)) Nanostructure Complexes
  Avat (Arman) Taherpour Leila Fathiyan
• Open Access Article
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  7 - Interaction of Pyrimidine Nucleobases with Silicon Carbide Nanotube: Effect of Functionalization on Stability and Solvation
  S. Ketabi S. M. Hashemianzadeh
• Open Access Article
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  8 - Prediction of accurate pKa values of some α-substituted carboxylic acids with low cost of computational methods
  M. Abul Kashem Liton Sabrina Helen Mukta Das Dipa Islam M. Rabiul Karim