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Computational and data-driven chemistry using artificial intelligence : fundamentals, methods and applications

Computational and data-driven chemistry using artificial intelligence : fundamentals, methods and applications
Paper図書
edited by Takashiro AkitsuElsevier[2022]<PA23-D2>
National Diet LibraryOther Libraries in Japan
  • Subject Heading... intelligence. Chemistry--Data processing.

Computational methods in organometallic catalysis : from elementary reactions to mechanisms

Computational methods in organometallic catalysis : from elementary reactions to mechanisms
Paper図書
Yu LanWiley-VCH2021<PA325-D39>
National Diet LibraryOther Libraries in Japan

Machine learning in chemistry : data-driven algorithms, learning systems, and predictions (ACS symposium series ; 1326)

Machine learning in chemistry : data-driven algorithms, learning systems, and predictions (ACS symposium series ; 1326)
Paper図書
Edward O. Pyzer-Knapp, editor, Teodoro Laino, editor.American Chemical Society[2019]<PA21-S2>
National Diet LibraryOther Libraries in Japan
  • Subject HeadingChemistry--Data processing. Machine learning.

Computational quantum chemistry Second edition

Computational quantum chemistry Second edition
Paper図書
Ram Yatan Prasad and PranitaCRC Press2021<PA47-D14>
National Diet LibraryOther Libraries in Japan
  • Subject Heading...hnical Quantum chemistry--Data processing.

Linear-scaling techniques in computational chemistry and physics : methods and applications (Challenges and advances in computational chemistry and physics ; 13)

Linear-scaling techniques in computational chemistry and physics : methods and applications (Challenges and advances in computational chemistry and physics ; 13)
Paper図書
edited by Robert Zaleśny ... [et al.].Springerc2011.<PA23-B13>
National Diet Library
  • Subject HeadingChemistry--Data processing. Physics--Data processing. Che...

Computational chemistry : introduction to the theory and applications of molecular and quantum mechanics 4th ed

Computational chemistry : introduction to the theory and applications of molecular and quantum mechanics 4th ed
Paper図書
Errol G. LewarsSpringerc2024
Other Libraries in Japan

Theory and applications in computational chemistry: the first decade of the second millennium : international congress TACC-2012 : Pavia, Italy 2-7 September 2012 : TACC 2012 : Sep 2012, Pavia, Italy. (AIP Conference Proceedings ; 1456)

Theory and applications in computational chemistry: the first decade of the second millennium : international congress TACC-2012 : Pavia, Italy 2-7 September 2012 : TACC 2012 : Sep 2012, Pavia, Italy. (AIP Conference Proceedings ; 1456)
Paper図書
American Institute of Physics2012.<M17-13-1813>
National Diet Library

Computational inorganic and bioinorganic chemistry (EIC books)

Computational inorganic and bioinorganic chemistry (EIC books)
Paper図書
editors, Edward I. Solomon, Robert A. Scott, R. Bruce King.Wiley2009.<X>
National Diet Library
  • Subject Heading.... Bioinorganic chemistry--Data processing. Chemistry, Inorganic--Data pr...

New horizons in computational chemistry software

New horizons in computational chemistry software
Paper図書
Michael Filatov, Cheol H. Choi, Massimo Olivucci, editorsSpringerc2022
Other Libraries in Japan

Data science in chemistry : artificial intelligence, big data, chemometrics, and quantum computing with Jupyter

Data science in chemistry : artificial intelligence, big data, chemometrics, and quantum computing with Jupyter
Paper図書
Thorsten GresslingDe Gruyterc2021
Other Libraries in Japan

Theory and applications of computational chemistry -- 2008 : Shanghai, China 23-27 September 2008. : TACC2008 symposium : theoretical and computational chemistry conference : TACC 2008 international conference : Sep 2008, Shanghai, China. (AIP Conference Proceedings ; 1102)

Theory and applications of computational chemistry -- 2008 : Shanghai, China 23-27 September 2008. : TACC2008 symposium : theoretical and computational chemistry conference : TACC 2008 international conference : Sep 2008, Shanghai, China. (AIP Conference Proceedings ; 1102)
Paper図書
American Institute of Physics2009.<M17-09-1958>
National Diet Library

Reviews in computational chemistry v. 32 : hbk

Reviews in computational chemistry v. 32 : hbk
Paper図書
edited by Abby L. Parrill, Kenny B. LipkowitzJohn Wiley & Sons2022
Other Libraries in Japan

Python for chemists : pbk

Python for chemists : pbk
Paper図書
Christian HillCambridge University Press2024
Other Libraries in Japan

Applied linear analysis for chemical engineers : a multi-scale approach with Mathematica pbk.

Applied linear analysis for chemical engineers : a multi-scale approach with Mathematica pbk.
Paper図書
Vemuri Balakotaiah, Ram R. RatnakarDe Gruyterc2023
Other Libraries in Japan

Annual reports in computational chemistry v. 17 : hbk

Annual reports in computational chemistry v. 17 : hbk
Paper図書
edited by David A. DixonElsevierc2021
Other Libraries in Japan

Annual reports in computational chemistry v. 16

Annual reports in computational chemistry v. 16
Paper図書
edited by David A. DixonElsevierc2020
Other Libraries in Japan

Chemoinformatics and bioinformatics in the pharmaceutical sciences : [pbk.]

Chemoinformatics and bioinformatics in the pharmaceutical sciences : [pbk.]
Paper図書
edited by Navneet Sharma ... [et al.]Academic Press, an imprint of Elsevierc2021
Other Libraries in Japan

Modern methods of drug discovery / edited by A. Hillisch and R. Hilgenfeld. (EXS ; 93)

Modern methods of drug discovery / edited by A. Hillisch and R. Hilgenfeld. (EXS ; 93)
Paper図書
Birkhäuserc2003.<SD21-B1>
National Diet LibraryOther Libraries in Japan

Handbook of computational chemistry : set 2nd ed

Handbook of computational chemistry : set 2nd ed
Paper図書
Jerzy Leszczynski, editorc2017
Other Libraries in Japan

Reaction-diffusion computers / Andy Adamatzky, Ben De Lacy Costello, Tetsuya Asai. 1st ed.

Reaction-diffusion computers / Andy Adamatzky, Ben De Lacy Costello, Tetsuya Asai. 1st ed.
Paper図書
Elsevier2005.<PA51-B13>
National Diet Library
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