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An Approach to Novel Structural Design by Combining Discrete Methods and Kernel Methods

Research Project

Project/Area Number 22240009
Research Category

Grant-in-Aid for Scientific Research (A)

Allocation TypeSingle-year Grants
Section一般
Research Field Intelligent informatics
Research InstitutionKyoto University

Principal Investigator

AKUTSU Tatsuya  京都大学, 化学研究所, 教授 (90261859)

Co-Investigator(Kenkyū-buntansha) NAGAMOCHI Hiroshi  京都大学, 情報学研究科, 教授 (70202231)
KAWABATA Takeo  京都大学, 化学研究所, 教授 (50214680)
HAYASHIDA Morihiro  京都大学, 化学研究所, 助教 (40402929)
Project Period (FY) 2010-04-01 – 2015-03-31
Project Status Completed (Fiscal Year 2014)
Budget Amount *help
¥42,510,000 (Direct Cost: ¥32,700,000、Indirect Cost: ¥9,810,000)
Fiscal Year 2013: ¥10,530,000 (Direct Cost: ¥8,100,000、Indirect Cost: ¥2,430,000)
Fiscal Year 2012: ¥10,530,000 (Direct Cost: ¥8,100,000、Indirect Cost: ¥2,430,000)
Fiscal Year 2011: ¥10,530,000 (Direct Cost: ¥8,100,000、Indirect Cost: ¥2,430,000)
Fiscal Year 2010: ¥10,920,000 (Direct Cost: ¥8,400,000、Indirect Cost: ¥2,520,000)
Keywords特徴ベクトル / カーネル法 / 化学構造 / グラフ理論 / 立体異性体 / 構造列挙 / 木構造 / 異性体 / ベンゼン環 / 構造比較 / 外平面的グラフ
Outline of Final Research Achievements

In this project, we studied a new approach for design of novel (chemical) structures by combining discrete methods (including graph theory/algorithms) and kernel methods. We developed algorithms for (i) enumerating tree-like chemical structures, (ii) enumerating tree-like chemical structures with benzene rings, (iii) enumerating tree-like chemical structures each having one additional ring, all from given upper and lower bounds of a feature vector consisting of frequency of labeled paths. Some of these algorithms were implemented in a significantly updated web server, EnuMol Version 2. We also analyzed computational complexity of a chemical structure comparison problem.

Report

(5 results)
  • 2014 Final Research Report ( PDF )
  • 2013 Annual Research Report
  • 2012 Annual Research Report
  • 2011 Annual Research Report
  • 2010 Annual Research Report
  • Research Products

    (59 results)

All 2014 2013 2012 2011 2010 Other

All Journal Article (29 results) (of which Peer Reviewed: 29 results) Presentation (26 results) (of which Invited: 1 results) Remarks (4 results)

  • [Journal Article] Prediction of heterotrimeric protein complexes by two-phase learning using neighboring kernels2014

    • Author(s)
      Peiying Ruan, Morihiro Hayashida, Osamu Maruyama, Tatsuya Akutsu
    • Journal Title

      BMC Bioinformatics

      Volume: 15

    • NAID

      120005372925

    • Related Report
      2013 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Breadth-first search approach to enumeration of tree-like chemical compounds2013

    • Author(s)
      Y. Zhao, M. Hayashida, J. Jindalertudomdee, H. Nagamochi and T. Akutsu
    • Journal Title

      Journal of Bioinformatics and Computational Biology

      Volume: 11 Issue: 06 Pages: 1143007-1143007

    • DOI

      10.1142/s0219720013430075

    • Related Report
      2013 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Flux balance impact degree : a new definition of impact degree to properly treat reversible reactions in metabolic networks2013

    • Author(s)
      Y. Zhao, T. Tamura, T. Akutsu and J-P. Vert
    • Journal Title

      Bioinformatics

      Volume: 29 Issue: 17 Pages: 2178-2185

    • DOI

      10.1093/bioinformatics/btt364

    • Related Report
      2013 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Prediction of heterodimeric protein complexes from weighted protein-protein interaction networks using novel features and kernel functions2013

    • Author(s)
      Peiying Ruan, Morihiro Hayashida, Osamu Maruyama, Tatsuya Akutsu
    • Journal Title

      PLoS ONE

      Volume: 8 Issue: 6 Pages: e65265-e65265

    • DOI

      10.1371/journal.pone.0065265

    • NAID

      120005296009

    • Related Report
      2013 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Prediction of protein-RNA residue-base contacts using two-dimensional conditional random field with the lasso2013

    • Author(s)
      Morihiro Hayashida, Mayumi Kamada, Jiangning Song, Tatsuya Akutsu
    • Journal Title

      BMC Systems Biology

      Volume: 7

    • Related Report
      2013 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Approximation and parameterized algorithms for common subtrees and edit distance between unordered trees2013

    • Author(s)
      Tatsuya Akutsu, Daiji Fukagawa, Magnus M. Halldorsson, Atsuhiro Takasu, Keisuke Tanaka
    • Journal Title

      Theoretical Computer Science

      Volume: 470 Pages: 10-22

    • DOI

      10.1016/j.tcs.2012.11.017

    • NAID

      120005241356

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A polynomial-time algorithm for computing the maximum common connected edge subgraph of outerplanar graphs of bounded degree2013

    • Author(s)
      Tatsuya Akutsu, Takeyuki Tamura
    • Journal Title

      Algorithms

      Volume: 6 Issue: 1 Pages: 119-135

    • DOI

      10.3390/a6010119

    • NAID

      120005243648

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Comparison and enumeration of chemical graphs2013

    • Author(s)
      Tatsuya Akutsu, Hiroshi Nagamochi
    • Journal Title

      Computational and Structural Biotechnology Journal

      Volume: 5 Issue: 6 Pages: e201302004-e201302004

    • DOI

      10.5936/csbj.201302004

    • NAID

      120005243649

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Inferring a graph from path frequency2012

    • Author(s)
      Tatsuya Akutsu, Daiji Fukagawa, Jesper Jansson, Kunihiko Sadakane
    • Journal Title

      Discrete Applied Mathematics

      Volume: 160 Issue: 10-11 Pages: 1416-1428

    • DOI

      10.1016/j.dam.2012.02.002

    • NAID

      120004057190

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Protein complex prediction via improved verification methods using constrained domain-domain matching2012

    • Author(s)
      Zhao, Y., Hayashida, M., Nacher, J. C., Nagamochi, H. and Akutsu, T
    • Journal Title

      International Journal of Bioinformatics Research and Applications

      Volume: vol. 8 Issue: 3/4 Pages: 210-227

    • DOI

      10.1504/ijbra.2012.048970

    • NAID

      120005243442

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A Clique-Based Method Using Dynamic Programming for Computing Edit Distance Between Unordered Trees2012

    • Author(s)
      Tomoya Mori, Takeyuki Tamura, Daiji Fukagawa, Atsuhiro Takasu, Etsuji Tomita, Tatsuya Akutsu
    • Journal Title

      Journal of Computational Biology

      Volume: 19(10) Issue: 10 Pages: 1089-1104

    • DOI

      10.1089/cmb.2012.0133

    • NAID

      120004920413

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] DAFS: simultaneous aligning and folding of RNA sequences via dual decomposition2012

    • Author(s)
      Kengo Sato, Yuki Kato, Tatsuya Akutsu, Kiyoshi Asai, Yasubumi Sakakibara
    • Journal Title

      Bioinformatics

      Volume: 28 Issue: 24 Pages: 3218-3224

    • DOI

      10.1093/bioinformatics/bts612

    • Related Report
      2012 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Two-level support vector regression approach for protein backbone torsion angle prediction from primary sequences2012

    • Author(s)
      J.Song, H.Tan, M.Wang, G.I.Webb, T.Akutsu
    • Journal Title

      PLoS ONE

      Volume: 7 Issue: 2 Pages: e30361-e30361

    • DOI

      10.1371/journal.pone.0030361

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Indexing All Rooted Subgraphs of a Rooted Graph2012

    • Author(s)
      T.Imada, H.Nagamochi
    • Journal Title

      IEICE Transactions on Information and Systems

      Volume: E95-D Issue: 3 Pages: 712-721

    • DOI

      10.1587/transinf.E95.D.712

    • NAID

      10030611480

    • ISSN
      0916-8532, 1745-1361
    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Enumerating tree-like chemical graphs with given upper and lower bounds on path frequencies2011

    • Author(s)
      M.Shimizu, H.Nagamochi, T.Akutsu
    • Journal Title

      BMC Bioinformatics

      Volume: 12 Issue: S14

    • DOI

      10.1186/1471-2105-12-s14-s3

    • NAID

      120004770232

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Using binding profiles to predict RNA binding sites of target RNAs2011

    • Author(s)
      U.Poolsap, Y.Kato, K.Sato, T.Akutsu
    • Journal Title

      Tournal of Bioinformatics and Computational Biology

      Volume: 9 Issue: 06 Pages: 697-713

    • DOI

      10.1142/s0219720011005628

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Efficient enumeration of stereoisomers of outerplanar chemical graphs using dynamic programming2011

    • Author(s)
      T.Imada, S.Ota, H.Nagamochi, T.Akutsu
    • Journal Title

      Journal of Chemical Information and Modeling

      Volume: 51 Issue: 11 Pages: 2788-2807

    • DOI

      10.1021/ci200084b

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Kernel Methods for Chemical Compounds: From Classification to Design2011

    • Author(s)
      T.Akutsu, H.Nagamochi
    • Journal Title

      IEICE Transactions on Information and Systems

      Volume: E94-D Issue: 10 Pages: 1846-1853

    • DOI

      10.1587/transinf.E94.D.1846

    • NAID

      10030193064

    • ISSN
      0916-8532, 1745-1361
    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Conditional random field approach to prediction of protein-protein interactions using domain information2011

    • Author(s)
      Hayashida, M., Kamada, M., Song, J. and Akutsu, T
    • Journal Title

      BMC Systems Biology

      Volume: vol. 5, Suppl. 1 Issue: Suppl 1 Pages: S8-S8

    • DOI

      10.1186/1752-0509-5-s1-s8

    • NAID

      120003238942

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] IPknot : fast and accurate prediction of RNA secondary structures with pseudoknots using integer programming2011

    • Author(s)
      K.Sato, Y.Kato, M.Hamada, T.Akutsu, K.Asai
    • Journal Title

      Bioinformatics

      Volume: 27 Issue: 13 Pages: i85-i93

    • DOI

      10.1093/bioinformatics/btr215

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Organocatalytic Chemoselective Monoacylation of 1,n-Linera Diols2011

    • Author(s)
      K.Yoshida, T.Furuta, T.Kawabata
    • Journal Title

      Angewandte Chemie International Edition

      Volume: 50 Issue: 21 Pages: 4888-4892

    • DOI

      10.1002/anie.201100700

    • Related Report
      2011 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Efficient enumeration of stereoisomers of tree structured molecules using dynamic programming2011

    • Author(s)
      T.Imada, S.Ota, H.Nagamochi, T.Akutsu
    • Journal Title

      Journal of Mathematical Chemistry

      Volume: 49 Pages: 910-970

    • NAID

      120003001339

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Generation of symmetric and asymmetric biconnected rooted triangulated planar graphs2011

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Journal Title

      IEICE Transactions

      Volume: 94-D Pages: 200-210

    • NAID

      130000453880

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Generation of symmetric and asymmetric biconnected rooted outerplanar graphs2011

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Journal Title

      IEICE Transactions

      Volume: 94-D Pages: 211-219

    • NAID

      130000453881

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Compound analysis via graph kernels incorporating chirality2010

    • Author(s)
      J.B.Brown, T.Urata, T.Tamura, M.A.Arai, T.Kawabata, T.Akutsu
    • Journal Title

      Journal of Bioinformatics and Computational Biology

      Volume: 8(Suppl.1) Pages: 63-81

    • NAID

      120002709552

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] A bisection algorithm for grammar-based compression of ordered trees2010

    • Author(s)
      T.Akutsu
    • Journal Title

      Information Processing Letters

      Volume: 110 Pages: 815-820

    • NAID

      120002949715

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] RactIP : fast and accurate prediction of RNA-RNA interaction using integer programming2010

    • Author(s)
      Y.Kato, K.Sato, M.Hamada, Y.Watanabe, K.Asai, T.Akutsu
    • Journal Title

      Bioinformatics

      Volume: 26

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Comparing biological networks via graph compression2010

    • Author(s)
      M.Hayashida, T.Akutsu
    • Journal Title

      BMC Systems Biology

      Volume: 4(Suppl.2)

    • NAID

      120002561281

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Integer programming-based method for grammar-based tree compression and its application to pattern extraction of glycan tree structures2010

    • Author(s)
      Y.Zhao, M.Hayashida, T.Akutsu
    • Journal Title

      BMC Bioinformatics

      Volume: 11(Suppl.11)

    • NAID

      120002723148

    • Related Report
      2010 Annual Research Report
    • Peer Reviewed
  • [Presentation] Prediction of heterotrimeric protein complexes by two-phase learning using neighboring kernels2014

    • Author(s)
      Peiying Ruan, Morihiro Hayashida, Osamu Maruyama, Tatsuya Akutsu
    • Organizer
      The 20th Asia Pacific Bioinformatics Conference
    • Place of Presentation
      Fudan University, Shanghai, China
    • Related Report
      2013 Annual Research Report
  • [Presentation] 代謝ネットワークの頑健性解析と化学グラフの比較と列挙2014

    • Author(s)
      阿久津 達也
    • Organizer
      第27期CAMM(コンピュータによる材料開発・物質設計を考える会)本例会
    • Place of Presentation
      アイビーホール, 東京
    • Related Report
      2013 Annual Research Report
    • Invited
  • [Presentation] ベンゼン環を持つ木状化学構造の幅優先探索による列挙手法2013

    • Author(s)
      Jira Jindalertudomdee, 林田 守広, 阿久津 達也
    • Organizer
      第36回情報化学討論会
    • Place of Presentation
      筑波大学
    • Related Report
      2013 Annual Research Report
  • [Presentation] Breadth first search approach to enumeration of tree-like chemical compounds2013

    • Author(s)
      Yang Zhao, Morihiro Hayashida, Jira Jindalertudomdee, Hiroshi Nagamochi, Tatsuya Akutsu
    • Organizer
      The 24th International Conference on Genome Informatics
    • Place of Presentation
      Matrix, Biopolis, Singapore
    • Related Report
      2013 Annual Research Report
  • [Presentation] パス頻度の上下限制約を満たす木状化合物の二段階列挙法2012

    • Author(s)
      鈴木政喜, 永持仁, 阿久津達也
    • Organizer
      情報処理学会・第28回バイオ情報学研究会
    • Place of Presentation
      東北大学
    • Year and Date
      2012-03-29
    • Related Report
      2011 Annual Research Report
  • [Presentation] Protein complex prediction via improved verification methods using constrained domain-domain matching2012

    • Author(s)
      Y.Zhao, M.Hayashida, J.Nacher
    • Organizer
      The Tenth Asia Pacific Bioinformatics Conference
    • Place of Presentation
      Rydges Melbourne, Australia
    • Year and Date
      2012-01-19
    • Related Report
      2011 Annual Research Report
  • [Presentation] A polynomial-time algorithm for computing the maximum common subgraph of outerplanar graphs of bounded degree2012

    • Author(s)
      Takeyuki Tamura, Tatsuya Akutsu
    • Organizer
      37th International Symposium on Mathematical Foundations of Computer Science
    • Place of Presentation
      Hotel Sorea Regia, Bratislava, Slovakia
    • Related Report
      2012 Annual Research Report
  • [Presentation] On the complexity of the maximum common subgraph problem for partial k-trees of bounded degree2012

    • Author(s)
      Takeyuki Tamura, Tatsuya Akutsu
    • Organizer
      23rd International Symposium on Algorithms and Computation
    • Place of Presentation
      National Taiwan University, Taipei, Taiwan
    • Related Report
      2012 Annual Research Report
  • [Presentation] Enumerating chemical graphs of 1-tree structure from given upper and lower bounds on path frequencies2012

    • Author(s)
      Masaki Suzuki, Hiroshi Nagamochi, Tatsuya Akutsu
    • Organizer
      23rd International Conference on Genome Informatics
    • Place of Presentation
      National Cheng Kung University, Tainan, Taiwan
    • Related Report
      2012 Annual Research Report
  • [Presentation] 上下限パス頻度に基づいた環構造を一つ持つ化合物の列挙法2012

    • Author(s)
      鈴木政喜, 永持仁, 阿久津達也
    • Organizer
      第35回情報化学討論会
    • Place of Presentation
      広島大学
    • Related Report
      2012 Annual Research Report
  • [Presentation] Enumerating tree-like chemical graphs with given upper and lower bounds on path frequencies2011

    • Author(s)
      M.Shimizu, H.Nagamochi, T.Akutsu
    • Organizer
      The 22nd International Conference on Genome Informatics
    • Place of Presentation
      Haeundae Grand Hotel, Busan, Korea
    • Year and Date
      2011-12-05
    • Related Report
      2011 Annual Research Report
  • [Presentation] An improved clique-based method for computing edit distance between rooted unordered trees2011

    • Author(s)
      森智弥, 田村武幸, 深川大路, 高須淳宏, 富田悦次, 阿久津達也
    • Organizer
      情報処理学会・第26回バイオ情報学研究会
    • Place of Presentation
      神戸大学
    • Year and Date
      2011-09-13
    • Related Report
      2011 Annual Research Report
  • [Presentation] An improved clique-based method for computing edit distance between unordered2011

    • Author(s)
      T.Akutsu, T.Mori, T.Tamura, D.Fukagawa, A.Takasu, E.
    • Organizer
      The 4th International Workshop on Intelligent Informatics in Biology and Medicine
    • Place of Presentation
      Korean Bible University, Seol, Korea
    • Year and Date
      2011-06-30
    • Related Report
      2011 Annual Research Report
  • [Presentation] Inference and enumeration of chemical structures from feature vectors2011

    • Author(s)
      T.Akutsu
    • Organizer
      IPAM Workshop II : Optimization, Search and Graph-Theoretical Algorithms for Chemical Compound Space
    • Place of Presentation
      ULCA, LA, USA
    • Year and Date
      2011-04-15
    • Related Report
      2011 Annual Research Report
  • [Presentation] 上下限付きパス頻度に基づく木状化合物の列挙2011

    • Author(s)
      清水雅章, 永持仁, 阿久津達也
    • Organizer
      情報処理学会バイオ情報学研究会
    • Place of Presentation
      京都大学化学研究所
    • Year and Date
      2011-03-10
    • Related Report
      2010 Annual Research Report
  • [Presentation] Listing triconnected rooted plane graphs2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      Combinatorial Optimization and Applications-4th International Conference, COCOA 2010
    • Place of Presentation
      Kailua-Kona, HI, USA
    • Year and Date
      2010-12-18
    • Related Report
      2010 Annual Research Report
  • [Presentation] Compound analysis via graph kernels incorporating chirality2010

    • Author(s)
      J.B.Brown, T.Urata, T.Tamura, M.A.Arai, T.Kawabata, T.Akutsu
    • Organizer
      The 21st International Conference on Genome Informatics
    • Place of Presentation
      The First World Hotel, Hangzhou, China
    • Year and Date
      2010-12-16
    • Related Report
      2010 Annual Research Report
  • [Presentation] Integer programming-based method for grammar-based tree compression and its application to pattern extraction of glycantree structures2010

    • Author(s)
      Y.Zhao, M.Hayashida, T.Akutsu
    • Organizer
      The 21st International Conference on Genome Informatics
    • Place of Presentation
      The First World Hotel, Hangzhou, China
    • Year and Date
      2010-12-16
    • Related Report
      2010 Annual Research Report
  • [Presentation] Generating trees on multisets2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      Algorithms and Computation-21st International Symposium, ISAAC 2010
    • Place of Presentation
      Jeju Island, Korea
    • Year and Date
      2010-12-15
    • Related Report
      2010 Annual Research Report
  • [Presentation] Data compression-based approaches to analysis of biological networks2010

    • Author(s)
      T.Akutsu
    • Organizer
      The 4th International Conference on Computational Systems Biology
    • Place of Presentation
      Suzhou University, Suzhou, China(招待講演)
    • Year and Date
      2010-09-09
    • Related Report
      2010 Annual Research Report
  • [Presentation] Constant time generation of trees with degree bounds2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      the 9th International Symposium on Operations Research and Its Applications (ISORA 2010)
    • Place of Presentation
      Chengdu, China
    • Year and Date
      2010-08-19
    • Related Report
      2010 Annual Research Report
  • [Presentation] Constant time generation of biconnected rooted plane graphs2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      Frontiers in Algorithmics, 4th International Workshop, FAW 2010
    • Place of Presentation
      Wuhan, China
    • Year and Date
      2010-08-11
    • Related Report
      2010 Annual Research Report
  • [Presentation] Mathematical models and computational methods for analysis of structures of biological networks2010

    • Author(s)
      T.Akutsu
    • Organizer
      The 2nd International Conference on Advanced Science and Technology
    • Place of Presentation
      Seagaia, Miyazaki, Japan(招待講演)
    • Year and Date
      2010-06-25
    • Related Report
      2010 Annual Research Report
  • [Presentation] Generating internally triconnected rooted plane graphs2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      Theory and Applications of Models of Computation, 7th Annual Conference, TAMC 2010
    • Place of Presentation
      Prague, Czech Republic
    • Year and Date
      2010-06-07
    • Related Report
      2010 Annual Research Report
  • [Presentation] Enumerating rooted graphs with reflectional block structures2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      Algorithms and Complexity, 7th International Conference, CIAC 2010
    • Place of Presentation
      Rome, Italy
    • Year and Date
      2010-05-26
    • Related Report
      2010 Annual Research Report
  • [Presentation] Efficient generation of symmetric and asymmetric biconnected rooted outerplanar graphs2010

    • Author(s)
      B.Zhuang, H.Nagamochi
    • Organizer
      The 3rd Annual Meeting of Asian Association for Algorithms and Computation (AAAC)
    • Place of Presentation
      POSTECH, Pohang, Korea
    • Year and Date
      2010-04-17
    • Related Report
      2010 Annual Research Report
  • [Remarks] 化学構造列挙サーバー(EnuMol)

    • URL

      http://sunflower.kuicr.kyoto-u.ac.jp/tools/enumol2/

    • Related Report
      2013 Annual Research Report
  • [Remarks] 化学構造列挙サーバー(EnuMol)

    • URL

      http://sunflower.kuicr.kyoto-u.ac.jp/tools/enumol2/

    • Related Report
      2012 Annual Research Report
  • [Remarks]

    • URL

      http://sunflower.kuicr.kyoto-u.ac.jp/tools/enumol2/

    • Related Report
      2011 Annual Research Report
  • [Remarks]

    • URL

      http://sunflower.kuicr.kyoto-u.ac.jp/tools/enumol/

    • Related Report
      2010 Annual Research Report

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Published: 2010-08-23   Modified: 2019-07-29  

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