Kimito Funatsu

2005
24	EE	Kimito Funatsu: A Novel Approach to Retrosynthetic Analysis Utilizing Knowledge Bases Derived from Reaction Databases. KES (1) 2005: 169-175
2003
23	EE	Kiyoshi Hasegawa, Masamoto Arakawa, Kimito Funatsu: Simultaneous determination of bioactive conformations and alignment rules by multi-way PLS modeling. Computational Biology and Chemistry 27(3): 211-216 (2003)
22	EE	Kiyoshi Hasegawa, Shigeo Matsuoka, Masamoto Arakawa, Kimito Funatsu: Multi-way PLS modeling of structure-activity data by incorporating electrostatic and lipophilic potentials on molecular surface. Computational Biology and Chemistry 27(3): 381-386 (2003)
21	EE	Masamoto Arakawa, Kiyoshi Hasegawa, Kimito Funatsu: Novel Alignment Method of Small Molecules Using the Hopfield Neural Network. Journal of Chemical Information and Computer Sciences 43(5): 1390-1395 (2003)
20	EE	Masamoto Arakawa, Kiyoshi Hasegawa, Kimito Funatsu: Application of the Novel Molecular Alignment Method Using the Hopfield Neural Network to 3D-QSAR. Journal of Chemical Information and Computer Sciences 43(5): 1396-1402 (2003)
2002
19	EE	Kiyoshi Hasegawa, Shigeo Matsuoka, Masamoto Arakawa, Kimito Funatsu: New Molecular Surface-based 3D-QSAR Method using Kohonen Neural Network and 3-way PLS. Computers & Chemistry 26(6): 583-589 (2002)
2001
18	EE	Hiroko Satoh, Hiroyuki Koshino, Kimito Funatsu, Tadashi Nakata: Representation of Molecular Configurations by CAST Coding Method. Journal of Chemical Information and Computer Sciences 41(5): 1106-1112 (2001)
2000
17	EE	Hiroko Satoh, Hiroyuki Koshino, Kimito Funatsu, Tadashi Nakata: Novel Canonical Coding Method for Representation of Three-Dimensional Structures. Journal of Chemical Information and Computer Sciences 40(3): 622-630 (2000)
1999
16	EE	Kiyoshi Hasegawa, Toshiro Kimura, Kimito Funatsu: GA Strategy for Variable Selection in QSAR Studies: Application of GA-Based Region Selection to a 3D-QSAR Study of Acetylcholinesterase Inhibitors. Journal of Chemical Information and Computer Sciences 39(1): 112-120 (1999)
15	EE	Koji Satoh, Kimito Funatsu: A Novel Approach to Retrosynthetic Analysis Using Knowledge Bases Derived from Reaction Databases. Journal of Chemical Information and Computer Sciences 39(2): 316-325 (1999)
14	EE	Hiroko Satoh, Sachiko Itono, Kimito Funatsu, Keiko Takano, Tadashi Nakata: A Novel Method for Characterization of Three-Dimensional Reaction Fields Based on Electrostatic and Steric Interactions toward the Goal of Quantitative Analysis and Understanding of Organic Reactions. Journal of Chemical Information and Computer Sciences 39(4): 671-678 (1999)
1998
13	EE	Hiroko Satoh, Oliver Sacher, Tadashi Nakata, Lingran Chen, Johann Gasteiger, Kimito Funatsu: Classification of Organic Reactions: Similarity of Reactions Based on Changes in the Electronic Features of Oxygen Atoms at the Reaction Sites1. Journal of Chemical Information and Computer Sciences 38(2): 210-219 (1998)
12	EE	Toshiro Kimura, Kiyoshi Hasegawa, Kimito Funatsu: GA Strategy for Variable Selection in QSAR Studies: GA-Based Region Selection for CoMFA Modeling. Journal of Chemical Information and Computer Sciences 38(2): 276-282 (1998)
1997
11	EE	Kiyoshi Hasegawa, Yoshikatsu Miyashita, Kimito Funatsu: GA Strategy for Variable Selection in QSAR Studies: GA-Based PLS Analysis of Calcium Channel Antagonists. Journal of Chemical Information and Computer Sciences 37(2): 306-310 (1997)
10	EE	Hiroshi Yoshida, Kimito Funatsu: Optimization of the Inner Relation Function of QPLS Using Genetic Algorithm. Journal of Chemical Information and Computer Sciences 37(6): 1115-1121 (1997)
1996
9	EE	Hiroko Satoh, Kimito Funatsu: Further Development of a Reaction Generator in the SOPHIA System for Organic Reaction Prediction. Knowledge-Guided Addition of Suitable Atoms and/or Atomic Groups to Product Skeleton. Journal of Chemical Information and Computer Sciences 36(2): 173-184 (1996)
8	EE	Toshiro Kimura, Yoshikatsu Miyashita, Kimito Funatsu, Shin-ichi Sasaki: Quantitative Structure-Activity Relationships of the Synthetic Substrates for Elastase Enzyme Using Nonlinear Partial Least Squares Regression. Journal of Chemical Information and Computer Sciences 36(2): 185-189 (1996)
7	EE	Kimito Funatsu, Shin-ichi Sasaki: Recent Advances in the Automated Structure Elucidation System, CHEMICS. Utilization of Two-Dimensional NMR Spectral Information and Development of Peripheral Functions for Examination of Candidates. Journal of Chemical Information and Computer Sciences 36(2): 190-204 (1996)
6	EE	Kiyoshi Hasegawa, Toshiro Kimura, Yoshikatsu Miyashita, Kimito Funatsu: Nonlinear Partial Least Squares Modeling of Phenyl Alkylamines with the Monoamine Oxidase Inhibitory Activities. Journal of Chemical Information and Computer Sciences 36(5): 1025-1029 (1996)
1995
5		Hiroko Satoh, Kimito Funatsu: SOPHIA, a Knowledge Base-Guided Reaction Prediction System - Utilization of a Knowledge Base Derived from a Reaction Database. Journal of Chemical Information and Computer Sciences 35(1): 34-44 (1995)
1994
4	EE	Kimito Funatsu, Binod P. Acharya, Shin-ichi Sasaki: Application of a digital 1H-NMR spectrum to the survival test of substructures and the assignment test. Journal of Chemical Information and Computer Sciences 34(4): 735-744 (1994)
3	EE	Kimito Funatsu, Minoru Nishizaki, Shin-ichi Sasaki: Introduction of NOE data to an automated structure elucidation system, CHEMICS. Three-dimensional structure elucidation using the distance geometry method. Journal of Chemical Information and Computer Sciences 34(4): 745-751 (1994)
1989
2	EE	Kimito Funatsu, Yutaka Susuta, Shin-ichi Sasaki: Introduction of two-dimensional NMR spectral information to an automated structure elucidation system, CHEMICS. Utilization of 2D-INADEQUATE information. Journal of Chemical Information and Computer Sciences 29(1): 6-11 (1989)
1988
1	EE	Kimito Funatsu, Nobuyoshi Miyabayashi, Shin-ichi Sasaki: Further development of structure generation in the automated structure elucidation system CHEMICS. Journal of Chemical Information and Computer Sciences 28(1): 18-28 (1988)

Coauthor Index

1	Binod P. Acharya	[4]
2	Masamoto Arakawa	[19] [20] [21] [22] [23]
3	Lingran Chen	[13]
4	Johann Gasteiger	[13]
5	Kiyoshi Hasegawa	[6] [11] [12] [16] [19] [20] [21] [22] [23]
6	Sachiko Itono	[14]
7	Toshiro Kimura	[6] [8] [12] [16]
8	Hiroyuki Koshino	[17] [18]
9	Shigeo Matsuoka	[19] [22]
10	Nobuyoshi Miyabayashi	[1]
11	Yoshikatsu Miyashita	[6] [8] [11]
12	Tadashi Nakata	[13] [14] [17] [18]
13	Minoru Nishizaki	[3]
14	Oliver Sacher	[13]
15	Shin-ichi Sasaki	[1] [2] [3] [4] [7] [8]
16	Hiroko Satoh	[5] [9] [13] [14] [17] [18]
17	Koji Satoh	[15]
18	Yutaka Susuta	[2]
19	Keiko Takano	[14]
20	Hiroshi Yoshida	[10]

Colors in the list of coauthors