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ORCIDInternational Journal of Chemoinformatics and Chemical Engineering, Volume 1
Volume 1, Number 1, 2011
- Jorge Gálvez, Miriam Parreño, Jordi Pla, Jaime Sánchez, María Gálvez-Llompart, Sergio Navarro, Ramón García-Domenech:
Application of Molecular Topology to the Prediction of Water Quality Indices of Alkylphenol Pollutants. 1-11 - Lionello Pogliani:
Graph-Theoretical Indices based on Simple, General and Complete Graphs. 12-28 - Kaveh Hariri Asli
, Faig Bakhman Ogli Naghiyev, Soltan Ali Ogli Aliyev, Hoosein Hariri Asli:
Modeling of Fluid Interaction Produced by Water Hammer. 29-41 - Mihai V. Putz, Ana-Maria Putz:
Logistic vs. W-Lambert Information in Quantum Modeling of Enzyme Kinetics. 42-60 - Ashutosh Kumar Gupta, Arindam Chakraborty, Santanab Giri, Venkatesan Subramanian, Pratim Kumar Chattaraj:
Toxicity of Halogen, Sulfur and Chlorinated Aromatic Compounds: A Quantitative-Structure-Toxicity-Relationship (QSTR). 61-74 - Abdelmalek Amine, Zakaria Elberrichi, Michel Simonet, Ali Rahmouni:
A Hybrid Approach Based on Self-Organizing Neural Networks and the K-Nearest Neighbors Method to Study Molecular Similarity. 75-95 - Mariela I. Profeta, J. R. Romero, L. A. C. Leiva, Nelly L. Jorge, M. E. Gomez Vara, Eduardo A. Castro:
Solvent Effect of Oxygen in the Thermolisys Decomposition of the Acetone Diperoxide. 96-102
Volume 1, Number 2, 2011
- Damian Jose Marino, Eduardo Alberto Castro, L. Massolo, A. Mueller, O. Herbarth, Alicia E. Ronco:
Characterization of Polycyclic Aromatic Hydrocarbon Profiles by Multivariate Statistical Analysis. 1-14 - Francisco Torrens, Gloria Castellano:
Using Chemical Structural Indicators for Periodic Classification of Local Anaesthetics. 15-35 - Shahram Arbab, A. Zeinolebadi, Parviz Noorpanah:
Exploring the Thermodynamic Aspects of Structure Formation During Wet-Spinning of Polyacrylonitrile Fibres. 36-52 - Tanmoy Chakraborty, Dulal C. Ghosh:
Correlation of the Drug Activities of Some Anti-Tubercular Chalcone Derivatives in Terms of the Quantum Mechanical Reactivity Descriptors. 53-65 - Alexei N. Pankratov, Nikolay A. Bychkov, Olga M. Tsivileva:
Hydrogen-Bonded Interactions in the Systems L-Cysteine - H2SeO3 and L-Cysteine -H2SeO4: A DFT Study. 66-76
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