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Quantum nanochemistry

Quantum nanochemistry
Paper図書
Mihai V. Putz.Apple Academic Press[2016]<PA47-B63>
National Diet Library
  • Subject Heading...uantum theory. QSAR (Biochemistry)

薬物設計のための疎水相互作用場の構築

薬物設計のための疎水相互作用場の構築
Paper図書
中馬寛, 徳島大学 [著][中馬寛]2002-2003<Y151-H14572094>
National Diet Library
  • Subject Headingab initio MO / log-P / n-Octanol / QSAR / 水素結合 / 疎水相互作用 / 溶媒接触表面積 / 溶...

Novel Methods for Chemical Compound Inference Based on Machine Learning and Mixed Integer Linear Programming

Novel Methods for Chemical Compound Inference Based on Machine Learning and Mixed Integer Linear Programming
Digital博士論文障害者向け資料あり
Zhu, Jianshen2023-09-25
Available onlineNational Diet LibraryOther Libraries in Japan
  • Subject HeadingInverse QSAR Machine Learning Mixed Intege...

医薬品安全性情報コミュニティ・知的共有基盤の活用と薬学部情報薬局教育研究への応用

医薬品安全性情報コミュニティ・知的共有基盤の活用と薬学部情報薬局教育研究への応用
Paper図書
山内あい子, 徳島大学 [著][山内あい子]2005-2006<Y151-H17590126>
National Diet Library
  • Subject Heading医薬品安全性情報コミュニティ / 知的共有基盤 / 薬学部情報薬局 / 情報医療薬学教育研究 / 薬物催奇形性予測 / 薬物胎盤通過性予測 / 薬物母乳移行性予測 / クリニアルQSAR

Quantitative drug design : a critical introduction / Yvonne Connolly Martin. 2nd ed.

Quantitative drug design : a critical introduction / Yvonne Connolly Martin. 2nd ed.
Paper図書
CRC Press/Taylor & Francisc2010.<SD71-B41>
National Diet Library
  • Contents...lecules for 3D QSAR Calculating ph......ed examples of QSAR calculations on erythromycin ...
  • Subject Heading...relationships. QSAR (Biochemistry) Drugs -- Desig...

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
  • Subject Heading...ta processing. QSAR (Biochemistry) Combinatorial ...

新規神経系用薬開発のための基礎的研究 パーキンソン病治療薬をめざして

新規神経系用薬開発のための基礎的研究 パーキンソン病治療薬をめざして
Paper図書
野田, 敦子, 九州大学1991-1992<Y151-H03671056>
National Diet Library
  • Subject Heading神経系用薬開発 ペントアンスレン型複素環化合物 QSAR解析 ドラツグデザイン モノアミンオキシダーゼ阻害物質 抗う...

Quantitative structure - activity relationship : a practical approach pbk.

Quantitative structure - activity relationship : a practical approach pbk.
Paper図書
Siavoush Dastmalchi, Maryam Hamzeh-Mivehroud and Babak SokoutiCRC Press2021
Other Libraries in Japan
  • Subject HeadingDrugs -- Structure-activity relationships QSAR (Biochemistry) Drugs -- Desig...
  • Subject Heading (ID)Drugs -- Structure-activity relationships QSAR (Biochemistry) Drugs -- Desig...

Computational toxicology : risk assessment for chemicals : cloth

Computational toxicology : risk assessment for chemicals : cloth
Paper図書
edited by Sean EkinsWiley2018
Other Libraries in Japan
  • Subject HeadingToxicology -- Mathematical models Toxicology -- Computer simulation QSAR (Biochemistry)
  • Subject Heading (ID)Toxicology -- Mathematical models Toxicology -- Computer simulation QSAR (Biochemistry)

Quantitative structure - activity relationship : a practical approach : hardback

Quantitative structure - activity relationship : a practical approach : hardback
Paper図書
Siavoush Dastmalchi, Maryam Hamzeh-Mivehroud, Babak SokoutiCRC Pressc2018
Other Libraries in Japan
  • Subject HeadingDrugs -- Structure-activity relationships QSAR (Biochemistry) Drugs -- Desig...
  • Subject Heading (ID)Drugs -- Structure-activity relationships QSAR (Biochemistry) Drugs -- Desig...

Memorial symposium for 50th anniversry of Hansch-Fujita approach

Memorial symposium for 50th anniversry of Hansch-Fujita approach
Paper図書
Memorial Sympoium Planning Committee (Fujita Conference)Memorial sympoium planning committee (Fujita Conference)2012
Other Libraries in Japan
  • Subject HeadingQSAR (Biochemistry)
  • Subject Heading (ID)QSAR (Biochemistry)

QSAR, rational approaches to the design of bioactive compounds : proceedings of the VIII European Symposium on Quantitative Structure-Activity Relationships, Sorrento, Italy, 9-13 September 1990 / edited by C. Silipo and A. Vittoria. (Pharmacochemistry library ; v. 16)

QSAR, rational approaches to the design of bioactive compounds : proceedings of the VIII European Symposium on Quantitative Structure-Activity Relationships, Sorrento, Italy, 9-13 September 1990 / edited by C. Silipo and A. Vittoria. (Pharmacochemistry library ; v. 16)
Paper図書
Elsevier1991.<M15-A7547>
National Diet Library
  • Subject HeadingQSAR (Biochemistry) -- Congresses....

Fundamental QSARs for metal ions : hardback

Fundamental QSARs for metal ions : hardback
Paper図書
John D. Walker, Michael C. Newman, Monica EnacheCRC Pressc2013
Other Libraries in Japan
  • Subject HeadingQSAR (Biochemistry) Metal ions -- ...
  • Subject Heading (ID)QSAR (Biochemistry) Metal ions -- ...

Skin Sensitization Study by Quantitative Structure-Activity Relationships (QSAR)

Skin Sensitization Study by Quantitative Structure-Activity Relationships (QSAR)
Digital文書・図像類
SATO, Kazuhiro, UMEMURA, Tomohiro, TAMURA, Tarou, KUSAKA, Yukinori日本動物実験代替法学会2009-12Alternatives to Animal Testing and Experimentation14 3p.940-946
Other Libraries in Japan
  • Subject Headingskin sensitization QSAR animal study occupational exp...
  • Note (General)...n the basis of QSAR technology. Sa......s is the first QSAR model for skin......tudies of this QSAR model are needed to improve i...

Predicting chemical toxicity and fate

Predicting chemical toxicity and fate
Paper図書
[edited by] Mark T.D. Cronin, David J. LivingstoneCRC Pressc2004
Other Libraries in Japan
  • Subject HeadingMolecular toxicology Toxicological chemistry QSAR (Biochemistry)
  • Subject Heading (ID)Molecular toxicology Toxicological chemistry QSAR (Biochemistry)

QSAR and molecular modeling studies in heterocyclic drugs 1 2

QSAR and molecular modeling studies in heterocyclic drugs 1 2
Paper図書
[edited by] Satya Prakash GuptaSpringerc2006
Other Libraries in Japan
  • Subject HeadingQSAR (Biochemistry) Drugs -- Desig...
  • Subject Heading (ID)QSAR (Biochemistry) Drugs -- Desig...

Evolutionary algorithms in molecular design

Evolutionary algorithms in molecular design
Paper図書
edited by David E. ClarkWiley-VCHc2000
Other Libraries in Japan
  • Subject HeadingQSAR (Biochemistry)
  • Subject Heading (ID)QSAR (Biochemistry)

Molecular descriptors in QSAR/QSPR

Molecular descriptors in QSAR/QSPR
Paper図書
by Mati KarelsonWiley-Intersciencec2000
Other Libraries in Japan
  • Subject HeadingQSAR (Biochemistry) -- Mathematica...
  • Subject Heading (ID)QSAR (Biochemistry) -- Mathematica...

Computational toxicology : risk assessment for pharmaceutical and environmental chemicals : cloth

Computational toxicology : risk assessment for pharmaceutical and environmental chemicals : cloth
Paper図書
edited by Sean EkinsWiley-Intersciencec2007
Other Libraries in Japan
  • Subject Heading...ter simulation QSAR (Biochemistry) Toxicology -- ...
  • Subject Heading (ID)...ter simulation QSAR (Biochemistry) Toxicology -- ...

Phytochemicals as bioactive agents

Phytochemicals as bioactive agents
Paper図書
edited by Wayne R. Bidlack ... [et al.]Technomic Pub. Co.c2000
Other Libraries in Japan
  • Subject HeadingPharmacognosy Materia medica, Vegetable Phytochemicals QSAR (Biochemistry) Antineoplastic...
  • Subject Heading (ID)Pharmacognosy Materia medica, Vegetable Phytochemicals QSAR (Biochemistry) Antineoplastic...
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