Journal Contents: International Journal of Chemoinformatics and Chemical Engineering (IJCCE)

Volume 7 (2018)
Issue 1
Article 1
Synthesis and Characterization of Chitosan-Poly Vinyl Alcohol-Graphene Oxide Nanocomposites (pages 1-12)
Fariba Saeedi (Department of Nanotechnology, University of Guilan, Guilan, Iran,), Arash Montazeri (Department of Nanotechnology, University of Guilan, Guilan, Iran), Yaser Bahari (Department of Nanotechnology, University of Guilan, Guilan, Iran), Malihe Pishvaee (Department of Resin and Additives, Institute for Color Science and Technology, Tehran, Iran), Mohammad Ranjbar (Department of Nanotechnology, University of Guilan, Guilan, Iran)
Article 2
Process Synthesis and the G-H Space for Analysing and Optimising Biomass Gasification (pages 13-41)
Lwazi Ngubevana (Saline Water Conversion Corporation, Riyadh, Saudi Arabia)
Article 3
Covalent Radii and New Applications (pages 42-51)
Yonghe Zhang (American Huilin Institute, New York, USA)
Article 4
The Extraction of Metal Contaminants Using Supercritical Carbon Dioxide (pages 52-60)
Sesik Kang (Catholic University of Pusan, Busan, Korea), Minsu Ju (Dongnam Institute of Radiological & Medical Sciences, Busan, Korea), Junghoon Kim (Catholic University of Pusan, Busan,Korea)
Volume 6 (2017)
Issue 1
Article 1
The Dispersion Effect of Carbon Nanotubes on the Viscoelastic Properties of Epoxy by Perez Model (pages 1-19)
Arash Montazeri (Nanotechnology Department, University of Guilan, Rasht, Guilan, Iran), Majid Chitsazzadeh (School of Metallurgy and Materials Engineering, College of Engineering, University of Tehran, Tehran, Iran), Roksana Azad (Engineering Department, Tonekabon Branch, Islamic Azad University, Tonekabon, Iran), Dorsa Madah (Engineering Department, Tonekabon Branch, Islamic Azad University, Tonekabon, Iran)
Article 2
A Quantitative Study on Simultaneous Effects of Governing Parameters in Electrospinning of Nanofibers using Modified Neural Network using Genetic Algorithm (pages 20-38)
Shayan Seyedin (Institute for Frontier Materials, Deakin University, Geelong, Australia), Shima Maghsoodloo (Textile Engineering Department, Faculty of Engineering, University of Guilan, Guilan, Iran), Vahid Mottaghitalab (Textile Engineering Department, Faculty of Engineering, University of Guilan, Guilan, Iran)
Article 3
Renewable Energy Consumption and its Impact on Economic Growth of OPEC Members (pages 39-47)
Mohamad Ali Dehghan Tafti (Economic Science Department, Yazd Islamic Azad University, Yazd, Iran), Ahad Mottaghitalab (Economic Science Department, Yazd Islamic Azad University, Yazd, Iran)
Article 4
Systematics of Anomalies in the Filling of Electron Orbitals of Chemical Elements (pages 48-62)
G. V. Zhizhin (Skolkovo, Saint - Petersburg, Russia)
Issue 2
Article 1
Rice Straw Extracted Cellulose Biocompatible Nanofiber (pages 1-20)
Matoore Lamani (Textile Engineering Department, Faculty of Engineering, University of Guilan, Rasht, Iran)
Article 2
Preparation and Characterization of Chitosan - Double Walled Carbon Nanotubes Hydrogels (pages 21-30)
Arash Montazeri (Department of Nanotechnology, University of Guilan, Rasht, Iran), Mojdeh Karjibani (Babol University of Medical Science, Babol, Iran)
Article 3
Fukui Indices as QSAR Model Descriptors: The Case of the Anti-HIV Activity of 1-2-[(Hydroxyethoxy) Methyl]-6-(Phenylthio) Thymine Derivatives (pages 31-44)
Ali Rahmouni (Modeling and Calculation Methods Laboratory, Tahar Moulay University of Saida, Saida, Algeria), Moufida Touhami (Modeling and Calculation Methods Laboratory, Tahar Moulay University of Saida, Saida, Algeria), Tahar Benaissa (Physical and Chemical Studies Laboratory, Tahar Moulay University of Saida, Saida, Algeria)
Article 4
Various Rate Law Orders Through Hydrolysis of Sodium Borohydride Over Co-M-Zr-B (M= Cr, Mo and W) Nano Catalyst (pages 45-61)
Mohammad Hassan Loghmani (Department of Nanotechnology, University of Guilan, Rasht, Iran)
Volume 5 (2016)
Issue 1
Article 1
Modeling, Simulation, and Thermally Optimization of Thermally-Coupled Distillation Columns (pages 1-11)
Fatemeh Safari (Department of Chemical Engineering, Isfahan University of Technology, Isfahan, Iran), Arjomand Mehrabani-Zeinabad (Department of Chemical Engineering, Isfahan University of Technology, Isfahan, Iran)
Article 2
An Investigation onto the Importance of Dimensionless Analysis in the Modeling of Electrospinning (pages 12-23)
Shima Maghsoodlou (Department of Engineering, University of Gulian, Rasht, Iran), Sulmaz Poreskandar (Department of Engineering, University of Gulian, Rasht, Iran)
Article 3
Laminar Mixed Convection in Two Concentric Vertical Cylinders (pages 24-43)
Ahmed Hadjadj (Faculty of Hydrocarbons and Chemistry, Boumerdes University, Boumerdes, Algeria), Seghir Maamir (Engineering Faculty, Boumerdes University, Boumerdes, Algeria)
Article 4
Capability of Bacterial Cellulose Membrane in Release of Doxycycline (pages 44-55)
Mohammad Ali Salehi (Department of Chemical Engineering, University of Guilan, Rasht, Iran), Masomeh Jahani Kadusarai (Department of Chemical Engineering, University of Guilan, Rasht, Iran), Mojtaba Akbari Dogolsar (Department of Textile Engineering, University of Guilan, Rasht, Iran)
Issue 2
Article 1
Controlling Electrospinning Jet Using Microscopic Model for Ideal Tissue Engineering Scaffolds (pages 1-16)
Shima Maghsoodlou (Department of Engineering, University of Gulian, Gulian, Iran), Sulmaz Poreskandar (Department of Engineering, University of Gulian, Gulian, Iran)
Article 2
Numerical Simulation of Single Droplet Hydrodynamics Affected by Electrostatic Forces with the Aid of CFD: CFD Simulation of Single Droplet Hydrodynamics (pages 17-34)
Mohammad Ali Salehi (University of Guilan, Guilan, Iran), Babak Namazi (University of Guilan, Guilan, Iran)
Article 3
The Impact of Electrostatic Forces on the Dynamic and Heat Transfer Coefficient of Single Bubble Rising: Electrostatic Forces Effect on the Dynamic of Single Bubble Rising by CFD (pages 35-46)
Mohammad Ali Salehi (University of Guilan, Guilan, Iran), Samaneh Poursaman (University of Guilan, Guilan, Iran)
Article 4
The Structure, Topological, and Functional Dimension of Biomolecules (pages 47-60)
Gennadiy Vladimirovich Zhizhin (Russian Ecological Academy, Saint-Petersburg, Russia)
Volume 4 (2015)
Issue 1
Article 1
Noise-Induced Stability Analysis of a Capillary Flow Microreactor with Mixing by Radial Diffusion of Laminar Flow Profiles (pages 1-15)
Pratap R. Patnaik (Department of Chemical Engineering, Gharda Institute of Technology, Maharashtra, India)
Article 2
The Treatment of Cheese Whey Wastewater by Waste Activated Sludge and Optimization of Treatment Conditions with Response Surface Methodology (pages 16-25)
Gholam Khayati (Department of Chemical Engineering, University of Guilan, Rasht, Iran), Morteza Barati (Department of Chemical Engineering, University of Guilan, Rasht, Iran)
Article 3
Extension of Ugi's Scheme for Model-Driven Classification of Chemical Reactions (pages 26-51)
Shyantani Maiti (Department of Computer Science and Technology, Bengal Engineering and Science University, Shibpur, Howrah, India), Sanjay Ram (Department of Computer Science and Technology, Bengal Engineering and Science University, Shibpur, Howrah, India), Somnath Pal (Department of Computer Science and Technology, Bengal Engineering and Science University, Shibpur, Howrah, India)
Article 4
Indications of Spontaneous Chaos in the Chemotaxis of E. coli under Noise-Induced Parametric Perturbations (pages 52-65)
Pratap R. Patnaik (Department of Chemical Engineering, C. V. Raman College of Engineering, Bhubaneswar, Bidyanagar, India)
Issue 2
Article 1
Modeling of Photo Catalytic Degradation of Chloramphenicol using Full Factorial Design (pages 1-12)
Mamta Dubey (Department of Chemical Engineering, ITM University, Gwalior, India), Mumtaj Shah (Department of Chemical Engineering, ITM University, Gwalior, India)
Article 2
A Novel Method for Evaluation of the Flow Field Effects on Mean Drop Size in a Multiphase CFB (pages 13-36)
Ali Akbar Jamali (School of Chemical Engineering, Iran University of Science and Technology (IUST), Tehran, Iran), Shahrokh Shahhosseini (School of Chemical Engineering, Iran University of Science and Technology (IUST), Tehran, Iran), Yaghoub Behjat (Process Development and Equipment Technology Division, Research Institute of Petroleum Industry, Tehran, Iran)
Article 3
Theoretical Study of Lamivudine Derivatives Invoking DFT based Descriptors (pages 37-45)
Tanmoy Chakraborty (Department of Chemistry, Manipal University Jaipur, Jaipur, India), Seema Dhail (Department of Chemistry, Manipal University Jaipur, Jaipur, India)
Article 4
The Prediction of the Performance of an Oil Reservoir by Proxy Model: A Case Study (pages 46-58)
Allahyar Daghbandan (Department of Chemical Engineering, University of Guilan, Rasht, Iran), Seyed Mahdi Chalik (Department of Chemical Engineering, University of Guilan, Rasht, Iran)
Volume 3 (2013)
Issue 1
Article 1
Influence of γ-Radiation on Optical and Electric Properties of 90Bi2Te3-10Bi2Se3 Doped Films of P-and N-Types Conductivity (pages 1-7)
Nadir Mamed og. Abdullayev (National Academy of Science, Baku, Azerbaijan), Faig Bakhman og. Naghiyev (Research and Development Center for High Technologies of Ministry of Communications and Information Technologies, Baku, Azerbaijan), Nasrulla Zeynal og Jalilov (National Academy of Science, Baku, Azerbaijan), Nazim Rza og Memmedov (National Academy of Science, Baku, Azerbaijan), Ilaha Telman q. Mamedova (National Academy of Science, Baku, Azerbaijan)
Article 2
Preparation of a Uranium Conversion Plant’s Nuclear Waste for Final Disposal by Means of Magnetically Assisted Chemical Separation (pages 8-18)
Ahad Ghaemi (School of Chemical Engineering, Iran University of Science and Technology, Tehran, Iran), Mehdi Maghsudi (Mehdi Maghsudi, Iran University of Science and Technology, Tehran, Iran), Fatemeh Hanifpour (Sharif University of Technology, Tehran, Iran), Mohammad Samadfam (Department of Energy Engineering, Sharif University of Technology, Tehran, Iran)
Article 3
Modeling of Inclusion by Genetic Algorithms: Application to the Beta-Cyclodextrin and Triphenylphosphine (pages 19-36)
Reda Mohamed Hamou (Department of Computer Science, Dr. Moulay Tahar University of Saïda, Saïda, Algeria), Abdelmalek Amine (Department of Computer Science, Dr. Moulay Tahar University of Saïda, Saïda, Algeria), Ali Rahmouni (Department of Chemistry, Dr. Moulay Tahar University of Saïda, Saïda, Algeria), Ahmed Chaouki Lokbani (Department of Computer Science, Dr. Moulay Tahar University of Saïda, Saïda, Algeria), Michel Simonet (TIMC Laboratory, Joseph Fourier University of Grenoble, Grenoble, France)
Article 4
Long Destruction of Structurally Damaged Composite Pipe (pages 37-47)
Akhundov Mohammed B. (Azerbaijan State Marine Academy & Institute of Mathematics and Mechanics of Azerbaijan-National Academy of Sciences, Baku, Azerbaijan), Sadayev Azber Sh. (Centre of Information Technology, Baku State University, Baku City, Azerbaijan)
Article 5
Some Recent Developments on the Synthesis, Chemical Reactivity, and Theoretical Studies of Tetroxanes (pages 48-73)
Nelly L. Jorge (Facultad de Ciencias Exactas y Naturales y Agrimensura, Universidad Nacional del Nordeste, Corrientes, Argentina), Alfonso Hernández-Laguna (Instituto Andaluz de Ciencias de la Tierra, Universidad de Granada, Granada, Spain), Eduardo A. Castro (Facultad de Ciencias Exactas, Universidad Nacional de La Plata, La Plata, Argentina)
Article 6
Graphene-Based Sensors for Monitoring Strain: A First-Principles Density Functional Theory Analysis (pages 74-83)
M. Mirnezhad (Department of Mechanical Engineering, University of Guilan, Rasht, Iran), R. Ansari (Department of Mechanical Engineering, University of Guilan, Rasht, Iran), H. Rouhi (Department of Mechanical Engineering, University of Guilan, Rash, Iran), M. Faghihnasiri (Department of Physics, University of Guilan, Rasht, Iran)
Issue 2
Article 1
Molecular Classification of 5-Amino-2-Aroylquinolines and 4-Aroyl-6,7,8-Trimethoxyquinolines as Highly Potent Tubulin Polymerization Inhibitors (pages 1-26)
Francisco Torrens (Institute for Molecular Science, Universitat de València, València, Spain), Gloria Castellano (Faculty of Veterinary and Experimental Sciences, Universidad Católica de Valencia San Vicente Mártir, València, Spain)
Article 2
K-Shell X-Ray Fluorescence Studies of Some Elements in the Atomic Number Range 26 = Z = 70 (pages 27-44)
Punchithaya K Sripathi (Department of Physics, Manipal University Jaipur, Jaipur, Rajasthan, India), K M Balakrishna (Department of Physics, Mangalore University, Mangalagangotri, Karnataka, India)
Article 3
A Three-Pass Algorithm for Generation of BE-Matrices from IUPAC Names (pages 45-63)
Sourav Mandal (Department of Computer Science and Technology, Bengal Engineering and Science University West Bengal, India), Somnath Pal (Department of Computer Science and Technology, Bengal Engineering and Science University, Howrah, West Bengal, India)
Article 4
Application of Molecular Topology to the Prediction of the Reaction Yield and Anticancer Activity of Imidazole and Guanidine Derivatives (pages 64-74)
Miguel Espinosa López (Molecular Connectivity and Drug Design Research Unit, Department of Physical Chemistry, University of Valencia, Valencia, Spain), Vincenzo La Franca Pitarresi (Molecular Connectivity and Drug Design Research Unit, Department of Physical Chemistry, University of Valencia, Valencia, Spain), Salvador Sayas Valero (Institute of Chemical Technology, University Polytechnic of Valencia, Valencia, Spain), Jorge Gálvez (Molecular Connectivity and Drug Design Research Unit, Department of Physical Chemistry, University of Valencia, Valencia, Spain), Ramón García-Domenech (Molecular Connectivity and Drug Design Research Unit, Department of Physical Chemistry, University of Valencia, Valencia, Spain)
Article 5
(Liquid + Liquid) Equilibrium for Ternary System of (Water + Phenol + Cyclohexane) at T = 298.2 K (pages 75-84)
Hossein Ghanadzadeh (University of Guilan, Rasht, Iran), Milad Sangashekan (University of Guilan, Rasht, Iran), Shahin Asan (University of Urmia, Urmia, Iran)
Article 6
Liquid-Liquid Equilibrium of the Ternary System Water/Formic Acid/1-Pentanol at T= 308.2 K (pages 85-93)
Hossein Ghanadzadeh (University of Guilan, Rasht, Iran), Shahin Asan (University of Urmia, Urmia, Iran), Milad Sangashekan (University of Guilan, Rasht, Iran)
Article 7
Modeling and Optimization of Poly Electrolyte Dosage in Water Treatment Process by GMDH Type- NN and MOGA (pages 94-106)
M. Akbarizadeh (Department of Chemical Engineering, Guilan University, Rasht, Iran), A. Daghbandan (Department of Chemical Engineering, Guilan University, Rasht, Iran), M. Yaghoobi (Rasht Water Treatment Plant, Rasht, Iran)
Article 8
Physical-Mechanical Model of Fibrous Polymerized Bar Deformation at the Neck Zone (pages 107-116)
Gabil G. Aliyev (Azerbaijan National Academy of Sciences, Baku, Azerbaijan)
Article 9
Dynamics of Metal Distribution in Cultivated Soil and Vegetables in Vicinity to Industrial Deposition: An Inference to Chemical Contamination of Food Chain (pages 117-124)
Sumanta Nayek (Basic Science Department, EIILM University, Sikkim, India), Suprakash Roy (Department of Chemistry, Malda Govt. Polytechnic College, Malda, West Bengal, India), Suvanka Dutta (Department of Chemistry, National Institute of Technology, Durgapur, India), Rajnarayan Saha (Department of Chemistry, National Institute of Technology, Durgapur, India), Tanmoy Chakraborty (Department of Chemistry, Manipal University Jaipur, Rajasthan, India)
Article 10
Restoration of Coherent Population Movement from Noise-Induced Chaos in the Chemotaxis of E. Coli: A Fractal Interpretation (pages 125-144)
Pratap R. Patnaik (Department of Chemical Engineering, C. V. Raman College of Engineering, Bhubaneswar-752-054, Odisha, India)
Volume 2 (2012)
Issue 1
Article 1
Theoretical Studies on the Structure and Spectroscopic Properties of 2,4-D (2,4-Diclorofenoxiacetic Acid) (pages 1-11)
María G. Andino (Universidad Nacional del Nordeste, Argentina), Mariela I. Profeta (Universidad Nacional del Nordeste, Argentina), Jorge M. Romero (Universidad Nacional del Nordeste, Argentina), Nelly L. Jorge (Universidad Nacional del Nordeste, Argentina), Eduardo A. Castro (Research Institute of Theoretical and Applied Physical-Chemistry (INIFTA), Argentina)
Article 3
Two-D Analysis of the Thermo-Mechanical Properties of ZrO2-Based Composites (pages 25-38)
Sedigheh Salehi (Katholieke Universiteit Leuven, Belgium), Vasyl Ryukhtin (Helmholtz-Zentrum Berlin for Materials and Energy, Germany), Petr Lukas (Nuclear Physics Institute, Czech Republic), Omer Van der Biest (Katholieke Universiteit Leuven, Belgium), Jef Vleugels (Katholieke Universiteit Leuven, Belgium)
Article 4
Wavy Motion of Viscous Bubbly Liquid in Tubes of Orthotropic Material (pages 39-47)
Rafael Yusif Amenzadeh (Baku State University, Azerbaijan), Akperli Reyhan Sayyad (Baku State University, Azerbaijan), Faig Bakhman Ogli Naghiyev (Baku State University, Azerbaijan)
Article 5
Bundlet Model for Single-Wall Carbon Nanotubes, Nanocones and Nanohorns (pages 48-98)
Francisco Torrens (Universitat de València, Spain), Gloria Castellano (Universidad Católica de Valencia, Spain)
Issue 2
Article 1
An Efficient Algorithm for Automating Classification of Chemical Reactions into Classes in Ugi’s Reaction Scheme (pages 1-14)
Sanjay Ram (Bengal Engineering and Science University, Shibpur, India), Somnath Pal (Bengal Engineering and Science University, Shibpur, India)
Article 2
Modelling Liquid Flow Through Carbon Nanotubes (pages 15-27)
Faig Bakhman Ogli Naghiyev (Ministry of Communications and Information Technologies of Azerbaijan Republic, Azerbaijan)
Article 3
Interactions Between Weighting Scheme and Similarity Coefficient in Similarity-Based Virtual Screening (pages 28-41)
John D. Holliday (University of Sheffield, UK), Peter Willett (University of Sheffield, UK), Hua Xiang (University of Sheffield, UK)
Article 4
Retrained Classification of Tyrosinase Inhibitors and “In Silico” Potency Estimation by Using Atom-Type Linear Indices: A Powerful Tool for Speed up the Discovery of Leads (pages 42-144)
Gerardo M. Casañola-Martín (Universitat de València, Spain, and Central University of Las Villas, Cuba), Mahmud Tareq Hassan Khan (GenØk – Center for Biosafety, Norway), Huong Le-Thi-Thu (Central University of Las Villas, Cuba), Yovani Marrero-Ponce (Central University of Las Villas, Cuba, and Universitat de València, Spain), Ramón García-Domenech (Universitat de València, Spain), Francisco Torrens (Universitat de València, Spain), Antonio Rescigno (Università di Cagliari, Italy)
Volume 1 (2011)
Issue 1
Article 1
Application of Molecular Topology to the Prediction of Water Quality Indices of Alkylphenol Pollutants (pages 1-11)
Jorge Gálvez (University of Valencia, Spain), Miriam Parreño (University of Valencia, Spain), Jordi Pla (University of Valencia, Spain), Jaime Sanchez (University of Valencia, Spain), María Gálvez-Llompart (University of Valencia, Spain), Sergio Navarro (University of Valencia, Spain), Ramón García-Domenech (University of Valencia, Spain)
Article 2
Graph-Theoretical Indices based on Simple, General and Complete Graphs (pages 12-28)
Lionello Pogliani (Università della Calabria, Italy)
Article 3
Modeling of Fluid Interaction Produced by Water Hammer (pages 29-41)
Kaveh Hariri Asli (Azerbaijan National Academy of Science, Azerbaijan), Faig Bakhman Ogli Naghiyev (Azerbaijan State Oil Academy, Azerbaijan), Soltan Ali Ogli Aliyev (Azerbaijan National Academy of Science, Azerbaijan), Hoosein Hariri Asli (Applied Science and Technology University, Iran)
Article 4
Logistic vs. W-Lambert Information in Quantum Modeling of Enzyme Kinetics (pages 42-60)
Mihai V. Putz (West University of Timişoara, Romania & Research and Development National Institute for Electrochemistry and Condensed Matter (INCEMC) Timişoara, Romania), Ana-Maria Putz (Timisoara Institute of Chemistry of Romanian Academy, Romania)
Article 5
Toxicity of Halogen, Sulfur and Chlorinated Aromatic Compounds: A Quantitative-Structure-Toxicity-Relationship (QSTR) (pages 61-74)
Ashutosh Kumar Gupta (Udai Pratap Autonomous College, India), Arindam Chakraborty (Indian Institute of Technology Kharagpur, India), Santanab Giri (Indian Institute of Technology Kharagpur, India), Venkatesan Subramanian (Central Leather Research Institute, India), Pratim Chattaraj (Indian Institute of Technology Kharagpur, India)
Article 6
A Hybrid Approach Based on Self-Organizing Neural Networks and the K-Nearest Neighbors Method to Study Molecular Similarity (pages 75-95)
Abdelmalek Amine (Tahar Moulay University, Algeria), Zakaria Elberrichi (Djillali Liabes University, Algeria), Michel Simonet (Fourier University, France), Ali Rahmouni (Tahar Moulay University, Algeria)
Article 7
Solvent Effect of Oxygen in the Thermolisys Decomposition of the Acetone Diperoxide (pages 96-102)
M. I. Profeta (Universidad Nacional del Nordeste, Argentina), J. R. Romero (Universidad Nacional del Nordeste, Argentina), L. A. C. Leiva (Universidad Nacional del Nordeste, Argentina), N. L. Jorge (Universidad Nacional del Nordeste, Argentina), M. E. Gomez Vara (Universidad Nacional del Nordeste, Argentina), E. A. Castro (INIFTA, Argentina)
Issue 2
Article 1
Characterization of Polycyclic Aromatic Hydrocarbon Profiles by Multivariate Statistical Analysis (pages 1-14)
D. J. Marino (Universidad Nacional de La Plata, Argentina), E. A. Castro (Universidad Nacional de La Plata, Argentina), L. Massolo (Universidad Nacional de La Plata, Argentina), A. Mueller (Centre of Environmental Research Leipzig-Halle GmbH, Germany), O. Herbarth (Centre of Environmental Research Leipzig-Halle GmbH, Germany), A. E. Ronco (Universidad Nacional de La Plata, Argentina)
Article 2
Using Chemical Structural Indicators for Periodic Classification of Local Anaesthetics (pages 15-35)
Francisco Torrens (Universitat de València, Spain), Gloria Castellano (Universidad Católica de Valencia San Vicente Mártir, Spain)
Article 3
Exploring the Thermodynamic Aspects of Structure Formation During Wet-Spinning of Polyacrylonitrile Fibres (pages 36-52)
Shahram Arbab (University of Guilan, Iran), A. Zeinolebadi (University of Hamburg, Germany), Parviz Noorpanah (Amirkabir University of Technology, Iran)
Article 4
Correlation of the Drug Activities of Some Anti-Tubercular Chalcone Derivatives in Terms of the Quantum Mechanical Reactivity Descriptors (pages 53-65)
Tanmoy Chakraborty (University of Kalyani, India), Dulal C. Ghosh (University of Kalyani, India)
Article 5
Hydrogen-Bonded Interactions in the Systems L-Cysteine - H2SeO3 and L-Cysteine -H2SeO4: A DFT Study (pages 66-76)
Alexei N. Pankratov (Institute of Chemistry, N. G. Chernyshevskii Saratov State University, Saratov, Russia), Nikolay A. Bychkov (Institute of Chemistry, N. G. Chernyshevskii Saratov State University, Saratov, Russia), Olga M. Tsivileva (Laboratory of Microbiology, Institute of Biochemistry and Physiology of Plants and Microorganisms, Russian Academy of Sciences, Saratov, Russia)