Artificial Neural Network Method for Predicting Protein Coding Genes in the Yeast GenomeA Life in ScienceA Theoretical Study of Intermolecular Interaction and Hydrogen Bond for Furan with HCl and CH4-nCln (n = 0-3)Aquatic Toxicity Prediction for Polar and Nonpolar Narcotic Pollutants with Support Vector MachinesA Computer Program for the Simulation of the NOE Effect in NMR Spectroscopy, and Its Implementation into the CICADA Conformational Search Program

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Artificial Neural Network Method for Predicting Protein Coding Genes in the Yeast Genome
The rapid growth of DNA sequences data in various DNA databanks has made analyzing these sequenc
A Life in Science
The author describes his family background, schooling, research, his teachers, his students, his
A Theoretical Study of Intermolecular Interaction and Hydrogen Bond for Furan with HCl and CH4-nCln (n = 0-3)
Furan has both the oxygen lone pair electrons and an aromatic π-electron. The study of the in
Aquatic Toxicity Prediction for Polar and Nonpolar Narcotic Pollutants with Support Vector Machines
Narcotic pollutants, that act by nonspecifically disrupting the functioning of cell membranes, a
A Computer Program for the Simulation of the NOE Effect in NMR Spectroscopy, and Its Implementation into the CICADA Conformational Search Program
Three-dimensional structure plays increasing role in the design of molecules with predefined fea
A Theoretical Study on the Chemopreventive Activity of Flavonoid Compounds
A structural and electronic characterization of some flavonoid compounds with chemopreventive ac
A Traditional Chinese Medicine Plant-Compound Database and Its Application for Searching
This article describes a Traditional Chinese Medicine Plant-Compound Database and an application
An Ant Colony Optimization-based Classifier System for Bacterial Growth
In predictive microbiology, identification of different combination of environmental factors (su
A Graphical Similarity Function to Help Ligand Docking to Proteins Based on the Molecular Lipophilicity Potential. The Case of the D2 Dopamine Receptor
Several recognition forces involved in ligand-receptor binding are also expressed in lipophilici
About the Hydration of Mg++: A Quantum DFT Study
The hydration of magnesium dication is studied using the DFT method BPW91/6-31G(d,p), which give
An Information-Theoretical Measure of Similarity and a Topological Shape and Size Descriptor for Molecular Similarity Analysis
Molecular similarity studies play an important role in today's drug discovery research for findi
A Density Functional Theory Study on the Role of Electronic Properties in the Antioxidant Activity of the Ajoene Molecule
The ajoene molecule is the main compound extracted of the garlic and besides its potential antio
A Surface-Based DNA Computing for the Simple 0-1 Programming Problem
DNA computing is a novel method of solving a class of intractable computational problem, in whic
A New Perturbation-Theoretic Approach to the Rovibronic Transition Matrix Elements of Diatomics
The line intensities of the transitions vJ ↔ v'J' where |J' - J| ≥ 1 are proportional to
A Combinatorial Protocol in Multiple Linear Regression to Model GasChromatographic Response Factor of Organophosphonate Esters
Organophosphorus compounds are a well known class of toxic chemicals which find their way into e
A Predictive Model for Blood-Brain Barrier Penetration
It is important to determine whether a candidate molecule is capable of penetrating the blood-br
A Theory of the Colossal Van der Waals Binding in Soft and Hard Condensed Matter
A simple theory is proposed for the dispersive molecular binding of unusually high magnitude due
Antioxidant Activity of Diphenylamine-Related Compounds as Scavengers of Carbon Radicals
Diphenylamine-related compounds, which are singlet oxygen scavengers, have been utilized as anti
Ab initio Computations for the Ring-Opening Potential of Propylene Oxide: Roles of a Proton and a Water Molecule
Ab initio computations for the ring-opening potential of propylene oxide were carried out
A Multivariate Study on the Inhibition of the Xanthine Oxidase by Phenylpyrazole Compounds
In this work, a set of phenylpyrazole compounds was studied in order to determine the molecular

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