| PosterID* |
Title |
Original ID |
| P1-01 |
Crystal structure and molecular dynamics simulation of ST0689 from Sulfolobus tokodaii strain7 |
4 |
| P1-02 |
Alkylation Mechanism of BPDE with DNA by Quantum Molecular Dynamics Simulation. |
13 |
| P1-03 |
Enantioselectivity of Candida antarctica Lipase TypeB toward Secondary Alcohols: Ab initio Fragment Molecular Orbital Study |
27 |
| P1-04 |
The Low-Frequency Raman Modes of Crystals of Guanosine Dihydrate Analyzed from MD Simulation |
48 |
| P1-05 |
Intra- and intermolecular interactions between cyclic-AMP receptor protein and DNA: Ab initio fragment molecular orbital study |
49 |
| P1-06 |
Development of virtual screening method using Solvation Free Energy Density Model(SFED) |
52 |
| P1-07 |
Computational Study of Catalytic Reaction of Adenylate Kinase |
65 |
| P1-08 |
NFV-Resistant Mechanism due to Non-active Site Mutation N88S on Subtype AE HIV-1 PRs |
66 |
| P1-09 |
Evaluation of the binding affinity of antibodies from antigen binding energy and VH-VL interaction energy calculated by the MM-GBSA method |
67 |
| P1-10 |
Prediction of complex structure comprised of a protein and a glycosaminoglycan using docking simulation and cluster analysis |
68 |
| P1-11 |
Catalytic reaction of the enzyme degrading biodegradable plastics |
69 |
| P2-01 |
In silico drug screening by docking score index method using principal component analysis |
2 |
| P2-02 |
Solvent Site-Dipole Field Mediating Docking of Biomolecules |
14 |
| P2-03 |
Application of Amino Acid Descriptors for Prediction of MHC-peptide binding affinity |
19 |
| P2-04 |
Molecular modeling and 3D-QSAR studies of benzothiazol-2-ylacetonitrile derivatives as c-Jun N-terminal kinase 3 inhibitors |
21 |
| P2-05 |
Bootstrap-based consensus scoring method for high-performance and robust drug screening by single scoring function |
22 |
| P2-06 |
introduction of initial binding orientation in protein- protein docking |
41 |
| P2-07 |
Functions of the key residues in the ligand-binding pocket of vitamin D receptor: Fragment molecular orbital-interfragment interaction energy analysis |
57 |
| P2-08 |
A Workbench for Selective Nuclear Receptor Modulators |
72 |
| P3-01 |
Discrimination of beta-barrel Membrane Proteins: Comparison between Statistical Methods and Machine Learning Algorithms |
1 |
| P3-02 |
SPLITS: an Expanding Program for Split and Intron-Containing tRNA Prediction |
10 |
| P3-03 |
Phylogenetic profiling approach to generate RNA-protein networks in E. coli |
12 |
| P3-04 |
Development and application of a molecular dynamics simulation system : myPresto |
15 |
| P3-05 |
Automatic Procaryote ORF Finding by Markov Model |
23 |
| P3-06 |
Prediction of nuclear localization proteins based on charge periodicity of 28 residues |
24 |
| P3-07 |
WinBEST-KIT (Biochemical Reaction Simulator for Analyzing Metabolic Pathways): Application to the System Analysis of Acetone-Butanol-Ethnol Fermentation in Clostridium saccharoperbutylacetonicum |
28 |
| P3-08 |
An Integrated Database of Flavonoids |
30 |
| P3-09 |
Estimation of Gene Regulatory Network by means of AdaBoost |
31 |
| P3-10 |
Theoretical studies of the ATP hydrolysis mechanism of HisP protein |
36 |
| P3-11 |
Proteins with charge periodicity of 28 residues which are coded in total genomes |
37 |
| P3-12 |
Systematic Errors Commonly Found in GeneChip Expression Data and Effective Compensation Methods thereof |
40 |
| P3-13 |
Protein functional site prediction -DNA binding protein- |
46 |
| P3-14 |
HP-Lattice-model Structure Prediction of Proteins |
50 |
| P3-15 |
Prediction of Human Cytochrome P450 3A4 Substrates using Statistical analysis |
53 |
| P3-16 |
Branch And Bound Median Search algorithm for finding a substrate specific motif at human SLC22 transporters |
58 |
| P3-17 |
A Molecular Modeling Study on Antigenic Drifts of Influenza Virus Surface Glycoprotein |
59 |
| P3-18 |
Analysis of amino acid sequences of motor protein by physical finger print method |
62 |
| P3-19 |
A New Method for Analysis of SNP’s Effect on Protein Function and Structure |
64 |
| P3-20 |
Application of Connectivity Matrix Method to Atom-level Analysis of Metabolic Networks: Calculation of Paths Connecting Two Metabolites |
70 |
| P4-01 |
Microarray analysis based on Standard Deviation of Effecting of Biological Factors |
5 |
| P4-02 |
Detecting Cell Cycle Regulated genes in S. pombe with Non-metric Multidimensional Scaling without sinusoidal fittings |
11 |
| P4-03 |
Comprehensive analyses on relationships between alternative-splicing patterns and developmental stages in mouse |
33 |
| P4-04 |
Genome-wide Prediction of Novel Small Peptides in Escherichia coli by Using Liquid Chromatography Mass Spectrometry |
34 |
| P4-05 |
Transcriptomic approach for understanding the effect of cryoprotectant, trehalose and DMSO of Saccharomyces cerevisiae |
44 |
| P4-06 |
GC contents of nucleotide sequences for proteins with charge periodicity of 28 residues |
51 |
| P5-01 |
PBPK-modeling as a tool for interpreting and understanding of pharmacokinetics |
3 |
| P5-02 |
Scaffold analysis of GPCR ligand datasets from literature. |
6 |
| P5-03 |
Development of New in silico Method for Predicting Drug Metabolism |
7 |
| P5-04 |
“CALTA”, a novel structure-property-activity profiling method: Compound-scaffold profiling and in silico prediction for the drug-discovery compounds that target membrane proteins |
8 |
| P5-05 |
Virtual Screening Models for Predicting Activities in Various Therapeutic Areas |
9 |
| P5-06 |
Convergence properties of absolute binding free energy calculation using BAR method |
16 |
| P5-07 |
Building up an original database of launched drugs for their ADME and physicochemical HTS profiling data and human PK data. |
17 |
| P5-08 |
Conceptual Design of a Framework for ADME Ontology |
18 |
| P5-09 |
Acquisition of Extended Information Regarding Chemicals-CYPs Interactions by Natural Language Processing |
25 |
| P5-10 |
Ontology Development for RTK-Associated Information Retrieval System |
26 |
| P5-11 |
Physiologically Based Pharmacokinetic (PBPK) model for pravastatin - Analysis of transporter-related pharmacokinetics - |
29 |
| P5-12 |
A Web-Based Drug Safety Information Community |
35 |
| P5-13 |
Instant Computing Technology for Molecular Design Environment for Non-Cluster Experts |
38 |
| P5-14 |
Conformational Analysis and Docking Study of the c-Jun N-Terminal Kinase Inhibitors Having a Benzothiazol Moiety |
42 |
| P5-15 |
Development of an Empirical Model for the Activation Energy of CYP Reaction |
43 |
| P5-16 |
Prediction of Skin Permeability for Chemical Penetration Enhnacers using Quantitative Structure Activity Relationship Analysis and Classification methodology |
54 |
| P5-17 |
In Silico Prediction of CYP1A2-mediated Metabolism |
55 |
| P5-18 |
Classification of P-Glycoprotein Substrates and Inhibitors |
56 |
| P5-19 |
NMR metabolomics 1/2 Multivariate analysis for diagnostic study of inherited metabolic disorders using human urine |
60 |
| P5-20 |
NMR metabolomics 2/2;Multivariate analysis for diagnostic study of streptozotocin-induced diabetes using rat urine |
61 |
| P5-21 |
Development of a database with simulation function for quantitative prediction of drug-drug interactions |
63 |
| P5-22 |
In vitro screening system using a combination of suspensions and monolayers of Caco-2 cells for detecting drug-drug interactions in intestinal absorption and conjugative metabolism of drugs |
73 |
| P5-23 |
Transport and metabolism of ampicillin prodrugs and their interactions with P-glycoprotein: in vitro study on successful prodrugs using Caco-2 cell monolayers |
74 |
| P6-01 |
Mathematical modeling of gene expression associated with Wnt signaling pathway in colorectal carcinoma |
32 |
| P6-02 |
Modeling of extracellular matrix degradation processes in cancer metastasis using covariance structure analysis |
39 |
| P6-03 |
Comprehensive analysis of drug-specific mutation patterns in protease gene of HIV-1 subtype B using decision tree |
47 |
| P7-01 |
Tutorial and Training Courses on Some Areas of Interest of the CBI Society |
71 |