Mircea V. Diudea, Biochem Press, O. Ivanciuc, T. Ivanciuc, A. T. Balaban, Ovidiu Ivanciuc, ...
252 BioChem Press
The Structural Interpretation of the Randi � Index # (2008)
Ovidiu Ivanciuc, Mircea V. Diudea, Ernesto Estrada, Biochem Press, E. Estrada, Ernesto Estrada
Motivation. The Randi � index is one of the most successful molecular descriptors in structure–property and structure–activity relationships studies. In spite of some attempts to interpret the...
Internet Electronic Journal of Molecular Design (2008)
Ovidiu Ivanciuc, Douglas J. Klein, Sonja Nikoli, Nenad Trinajsti, Biochem Press
The spoken word vanishes into air – The written words stand time. Anonymous Internet Electron. J. Mol. Des. 2003, 2 (7), 413–434 The author describes his family background, schooling, research,...
Ovidiu Ivanciuc, Bhaskar D. Kulkarni, Biochem Press, R. Kumar, A. Kulkarni, V. K. Jayaraman, ...
Motivation. Structure–activity relationships are characterized by large dimensions and conventional procedures become protracted while modeling these relationships. To enhance the modeling...
Building–Block Computation of the Ivanciuc–Balaban Indices for the Virtual Screening (2008)
Mircea V. Diudea, Biochem Press, O. Ivanciuc, Ovidiu Ivanciuc, Ovidiu Ivanciuc, Ovidiu Ivanciuc
Motivation. The discovery of drug leads is significantly accelerated by in silico screening of molecular libraries, that starts from a collection of chemical compounds with a high structural...
Internet Electronic Journal of Molecular Design (2008)
Ovidiu Ivanciuc, Douglas J. Klein, Jin Xu, Biochem Press, Z. Yin, J. Zhang, ...
BioChem Press
Internet Electronic Journal of Molecular Design (2008)
Ovidiu Ivanciuc, Douglas J. Klein, Bing Liu, Aijun Lu, Lei Zhang, Haibo Liu, ...
Based on the topological scaffold classification approach to cluster a structural database, we propose a new criterion to evaluate the diversity of a chemical structural database. This criterion is...
Kekulé Structure Counts in Damaged Benzenoid Parallelograms # (2008)
István Lukovits, Nenad Trinajsti, Biochem Press, I. Lukovits, N. Trinajsti, István Lukovits, ...
Citation of the article:
Internet Electronic Journal of Molecular Design (2008)
Ovidiu Ivanciuc, Mircea V. Diudea, Biochem Press, S. �s. Liu, H. �l. Liu, Y. �y. Shi, ...
Inhibition by 2,3�Diarylcyclopentenones Based on MEDV–13, Internet Electron. J. Mol. Des.
Numerical characterization of DNA primary sequence, Internet (2008)
Ovidiu Ivanciuc, Biochem Press, P. He, J. Wang, Jun Wang, Jun Wang
Special issue dedicated to Professor Haruo Hosoya on the occasion of the 65 th birthday
Finding Protein Coding Genes in the Yeast Genome Based on the Characteristic Sequences # (2008)
Chun Li, Jun Wang, Biochem Press, P. He, C Li, J Wang, ...
Motivation. Due to the rapid growth of DNA sequences data in various databases, the development of accurate algorithms for gene prediction is of great importance. The motivation of this paper is to...
A Modified Distance Matrix to Distinguish Cis/Trans Isomers (2008)
Mircea V. Diudea, Of Cycloalkanes, Chenzhong Cao, Hua Yuan, Biochem Press, C. Cao, ...
The general distance matrix D was modified to distinguish cis/trans isomers of cycloalkanes. A new topological index, VDI(±1), was derived from the modified distance matrix (Dmod) according to the...
Artificial Neural Network Method for Predicting Protein (2008)
Ovidiu Ivanciuc, Douglas J. Klein, Sonja Nikoli, Chun Li, Jun Wang, Biochem Press, ...
Motivation. The rapid growth of DNA sequences data in various DNA databanks has made analyzing these sequences, especially, finding genes in them very important, and it is even a more critical task...
The Topological Index Z Before and After 1971 (2008)
Haruo Hosoya, Biochem Press, H. Hosoya, Haruo Hosoya
The author’s first paper on the topological index Z was published in Bull. Chem. Soc. Jpn. in 1971, where good correlation was found between the boiling points of alkane isomers and their Z values....
Quantitative Descriptor for SNP Related Gene Sequences # (2008)
Ovidiu Ivanciuc, Mircea V. Diudea, Ashesh N, Papiya N, Subhash C. Basak, Biochem Press, ...
Motivation. The rapid growth of DNA sequence information relating to various gene sequences makes it imperative to have quantitative measures to compare and contrast the different sequences. This is...
Internet Electronic Journal of Molecular Design (2008)
Haibo Ma, Yi Gao, Xin Li, Jing Ma, Chungen Liu, Yuansheng Jiang, ...
BioChem Press
On the Mechanism of Glycoside Hydrolysis by the Family GH–90 Phage P22 Tailspike Protein (2008)
Ovidiu Ivanciuc, Wim Nerinckx, Tom Desmet, Marc Claeyssens, Biochem Press, W. Nerinckx, ...
The mechanism of the glycoside hydrolase family 90 Salmonella phage P22 tailspike protein was reevaluated by automated docking using Autodock3, with O–antigen oligosaccharide fragments having...
Internet Electronic Journal of Molecular Design (2008)
Ovidiu Ivanciuc, Douglas J. Klein, Biochem Press, Q. –n. Hu, Y. –z. Liang, Biochem Press
Based on the structure information of the mathematical characteristics of the degree distribution of saturated hydrocarbons, a method to count the branching number of a saturated hydrocarbon is...
Tailored Similarity Spaces for the Prediction of Physicochemical Properties # (2008)
Ovidiu Ivanciuc, Mircea V. Diudea, Brian D. Gute, Subhash C. Basak, Denise Mills, Douglas M. Hawkins, ...
Motivation. In the past, molecular similarity spaces have been developed from arbitrary sets of molecular properties or theoretical descriptors and the results of property estimation based on these...
Computing the Permanent of the Adjacency Matrix for (2008)
Mircea V. Diudea, Francisco Torrens, Biochem Press, F. Torrens
Motivation. Novel carbon allotropes, with finite molecular structure, including spherical fullerenes are nowadays currently produced and investigated. These compounds have beautiful architectures and...
Ovidiu Ivanciuc, Biochem Press, O. Ivanciuc, Ovidiu Ivanciuc
Support vector machines were developed by Vapnik as an effective algorithm for determining an optimal hyperplane to separate two classes of patterns. Comparative studies showed that support vector...
Maria Paula, P. Ramos, Lousã Lopes, Vicente P, ...
Motivation. Natural products are substances generally obtained in mixtures from natural sources. For identification and structure determination it is necessary to isolate each compound present in the...
Investigations on Evolutionary Changes in Base Distributions (2002)
Ovidiu Ivanciuc, Ashesh Nandy, Biochem Press, A. Nandy, Ashesh Nandy
Motivation. We had observed that 2D graphical plots of DNA sequences show apparently systematic variations among members of families of gene sequences and reported these to be due to evolutionary...
The Numerical Characterization and Similarity Analysis of DNA Primary Sequences # (2002)
Ovidiu Ivanciuc, Yachun Liu, Biochem Press, Y. Liu, Yachun Liu
Motivation. DNA sequencing has become routine and has resulted in an abundance of data on primary sequences of DNA for various species. Hence, we faced the task of process such great amount of data,...