JPWO2023008173A1 - - Google Patents

Info

Publication number
JPWO2023008173A1
JPWO2023008173A1 JP2023538412A JP2023538412A JPWO2023008173A1 JP WO2023008173 A1 JPWO2023008173 A1 JP WO2023008173A1 JP 2023538412 A JP2023538412 A JP 2023538412A JP 2023538412 A JP2023538412 A JP 2023538412A JP WO2023008173 A1 JPWO2023008173 A1 JP WO2023008173A1
Authority
JP
Japan
Legal status (The legal status is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the status listed.)
Pending
Application number
JP2023538412A
Other versions
JPWO2023008173A5 (ja
Priority date (The priority date is an assumption and is not a legal conclusion. Google has not performed a legal analysis and makes no representation as to the accuracy of the date listed.)
Filing date
Publication date
Application filed filed Critical
Publication of JPWO2023008173A1 publication Critical patent/JPWO2023008173A1/ja
Publication of JPWO2023008173A5 publication Critical patent/JPWO2023008173A5/ja
Pending legal-status Critical Current

Links

Classifications

    • G—PHYSICS
    • G06—COMPUTING; CALCULATING OR COUNTING
    • G06N—COMPUTING ARRANGEMENTS BASED ON SPECIFIC COMPUTATIONAL MODELS
    • G06N5/00—Computing arrangements using knowledge-based models
    • G06N5/02—Knowledge representation; Symbolic representation
    • G06N5/022—Knowledge engineering; Knowledge acquisition
    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
    • G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
    • G16C20/70—Machine learning, data mining or chemometrics
    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
    • G16C20/00—Chemoinformatics, i.e. ICT specially adapted for the handling of physicochemical or structural data of chemical particles, elements, compounds or mixtures
    • G16C20/30—Prediction of properties of chemical compounds, compositions or mixtures
    • G—PHYSICS
    • G16—INFORMATION AND COMMUNICATION TECHNOLOGY [ICT] SPECIALLY ADAPTED FOR SPECIFIC APPLICATION FIELDS
    • G16C—COMPUTATIONAL CHEMISTRY; CHEMOINFORMATICS; COMPUTATIONAL MATERIALS SCIENCE
    • G16C60/00—Computational materials science, i.e. ICT specially adapted for investigating the physical or chemical properties of materials or phenomena associated with their design, synthesis, processing, characterisation or utilisation
    • G—PHYSICS
    • G06—COMPUTING; CALCULATING OR COUNTING
    • G06N—COMPUTING ARRANGEMENTS BASED ON SPECIFIC COMPUTATIONAL MODELS
    • G06N3/00—Computing arrangements based on biological models
    • G06N3/02—Neural networks
    • G06N3/04—Architecture, e.g. interconnection topology
    • G06N3/042—Knowledge-based neural networks; Logical representations of neural networks
    • G—PHYSICS
    • G06—COMPUTING; CALCULATING OR COUNTING
    • G06N—COMPUTING ARRANGEMENTS BASED ON SPECIFIC COMPUTATIONAL MODELS
    • G06N3/00—Computing arrangements based on biological models
    • G06N3/02—Neural networks
    • G06N3/04—Architecture, e.g. interconnection topology
    • G06N3/0464—Convolutional networks [CNN, ConvNet]
    • G—PHYSICS
    • G06—COMPUTING; CALCULATING OR COUNTING
    • G06N—COMPUTING ARRANGEMENTS BASED ON SPECIFIC COMPUTATIONAL MODELS
    • G06N3/00—Computing arrangements based on biological models
    • G06N3/02—Neural networks
    • G06N3/08—Learning methods
    • G06N3/09—Supervised learning

Landscapes

  • Engineering & Computer Science (AREA)
  • Theoretical Computer Science (AREA)
  • Computing Systems (AREA)
  • Life Sciences & Earth Sciences (AREA)
  • Bioinformatics & Cheminformatics (AREA)
  • Bioinformatics & Computational Biology (AREA)
  • General Engineering & Computer Science (AREA)
  • Evolutionary Computation (AREA)
  • Artificial Intelligence (AREA)
  • Data Mining & Analysis (AREA)
  • Software Systems (AREA)
  • Crystallography & Structural Chemistry (AREA)
  • Chemical & Material Sciences (AREA)
  • Mathematical Physics (AREA)
  • Physics & Mathematics (AREA)
  • Computational Linguistics (AREA)
  • General Physics & Mathematics (AREA)
  • Computer Vision & Pattern Recognition (AREA)
  • Medical Informatics (AREA)
  • General Health & Medical Sciences (AREA)
  • Databases & Information Systems (AREA)
  • Health & Medical Sciences (AREA)
  • Management, Administration, Business Operations System, And Electronic Commerce (AREA)
JP2023538412A 2021-07-27 2022-07-12 Pending JPWO2023008173A1 (ja)

Applications Claiming Priority (2)

Application Number Priority Date Filing Date Title
JP2021122633 2021-07-27
PCT/JP2022/027344 WO2023008173A1 (ja) 2021-07-27 2022-07-12 探索方法、探索システム、プログラム、予測モデル構築方法、及び予測モデル構築装置

Publications (2)

Publication Number Publication Date
JPWO2023008173A1 true JPWO2023008173A1 (ja) 2023-02-02
JPWO2023008173A5 JPWO2023008173A5 (ja) 2024-04-22

Family

ID=85086780

Family Applications (1)

Application Number Title Priority Date Filing Date
JP2023538412A Pending JPWO2023008173A1 (ja) 2021-07-27 2022-07-12

Country Status (4)

Country Link
US (1) US20240144046A1 (ja)
JP (1) JPWO2023008173A1 (ja)
CN (1) CN117678025A (ja)
WO (1) WO2023008173A1 (ja)

Family Cites Families (2)

* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
WO2020054841A1 (ja) * 2018-09-14 2020-03-19 富士フイルム株式会社 化合物探索方法、化合物探索プログラム、記録媒体、及び化合物探索装置
JP2020166706A (ja) * 2019-03-29 2020-10-08 株式会社クロスアビリティ 結晶形予測装置、結晶形予測方法、ニューラルネットワークの製造方法、及びプログラム

Also Published As

Publication number Publication date
US20240144046A1 (en) 2024-05-02
WO2023008173A1 (ja) 2023-02-02
CN117678025A (zh) 2024-03-08

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Legal Events

Date Code Title Description
A521 Request for written amendment filed

Free format text: JAPANESE INTERMEDIATE CODE: A523

Effective date: 20231227