المؤلفون: Barazorda Ccahuana, Haruna Luz

المساهمون: University/Department: Universitat de Barcelona. Facultat de Química

مرشدي الرسالة: Madurga Díez, Sergio, Mas i Pujadas, Francesc

المصدر: TDX (Tesis Doctorals en Xarxa)

مصطلحات موضوعية: Quimioinformàtica, Quimioinformática, Cheminformatics, Dinàmica molecular, Dinámica molecular, Molecular dynamics, Simulació per ordinador, Simulación por ordenador, Computer simulation, Ciències Experimentals i Matemàtiques

وصف الملف: application/pdf

الوصول الحر: http://hdl.handle.net/10803/689422Test

المؤلفون: Revanasiddappa, Prasanna D.¹ (AUTHOR), Gowtham, H. G.² (AUTHOR), G. S., Chikkanna³ (AUTHOR), Gangadhar, Suchithra¹ (AUTHOR), A., Satish⁴ (AUTHOR), Murali, M.⁵ (AUTHOR) botany.murali@gmail.com, Shivamallu, Chandan⁶ (AUTHOR), Achar, Raghu Ram⁷ (AUTHOR), Silina, Ekaterina^8,9 (AUTHOR), Stupin, Victor⁹ (AUTHOR), Manturova, Natalia⁹ (AUTHOR), Shati, Ali A.^10,11 (AUTHOR), Alfaifi, Mohammad Y.^10,11 (AUTHOR), Elbehairi, Serag Eldin I.^10,11 (AUTHOR), Kollur, Shiva Prasad¹² (AUTHOR) botany.murali@gmail.com, Amruthesh, Kestur Nagaraj⁵ (AUTHOR) botany.murali@gmail.com

المصدر: PLoS ONE. 6/18/2024, Vol. 19 Issue 6, p1-29. 29p.

مصطلحات موضوعية: *XANTHOMONAS, *CHEMINFORMATICS, *BINDING energy, *DRUG standards, *LIGANDS (Biochemistry), *MEDICAL informatics, *ANTIBACTERIAL agents

المؤلفون: Blakey, Michael¹ (AUTHOR) M.Blakey@soton.ac.uk, Pearman-Kanza, Samantha¹ (AUTHOR), Frey, Jeremy G.¹ (AUTHOR)

المصدر: Journal of Cheminformatics. 4/15/2024, Vol. 16 Issue 1, p1-15. 15p.

مصطلحات موضوعية: *FINITE state machines, *CHEMINFORMATICS, *PATTERN matching, *DATABASES, *CHEMICAL storage, *SHOW jumping

المؤلفون: Al-Saray, Sarah T.¹ saraalsaray@uomisan.edu.iq

المصدر: Misan Journal of Academic Studies. Mar2024, Vol. 23 Issue 49, p113-124. 12p.

مصطلحات موضوعية: *CARDIOVASCULAR agents, *CHEMINFORMATICS, *CELLULAR signal transduction, *BANKING industry, *FETAL development, *PROTEIN drugs

العنوان البديل: Re-Thinking about Teaching Reform in the New Era of Artificial Intelligence.

المؤلفون: 翟红林¹ zhaihl@lzu.edu.cn, 张晓昀¹, 曹晶晶¹

المصدر: University Chemistry. 2024, Vol. 39 Issue 1, p63-68. 6p.

مصطلحات موضوعية: *ARTIFICIAL intelligence, *CHEMINFORMATICS, *REFORMS

المؤلفون: DJOUMBOU-FEUNANG, YANNICK¹ yannick.djoumboufeunang@corteva.com, Wilmot, Jeremy², Kinney, John¹, Chanda, Pritam¹, Yu, Pulan², Sader, Avery², Sharifi, Max³, Smith, Scott¹, Ou, Junjun², Jie Hu¹, Shipp, Elizabeth⁴, Tomandl, Dirk⁵, Kumpatla, Siva P.⁶, Xiuling Yu⁷

المصدر: Frontiers in Chemistry. 2023, p01-29. 29p.

مصطلحات موضوعية: *CHEMINFORMATICS, *ARTIFICIAL intelligence, *MACHINE learning, *SUSTAINABILITY, *AGRICULTURAL chemicals

المؤلفون: Chandrasekhar, Venkata¹ (AUTHOR), Sharma, Nisha¹ (AUTHOR), Schaub, Jonas¹ (AUTHOR), Steinbeck, Christoph¹ (AUTHOR), Rajan, Kohulan¹ (AUTHOR) kohulan.rajan@uni-jena.de

المصدر: Journal of Cheminformatics. 10/16/2023, Vol. 15 Issue 1, p1-11. 11p.

مصطلحات موضوعية: *CHEMINFORMATICS, *SOFTWARE development tools, *SOFTWARE as a service, *CHEMICAL structure

المؤلفون: Richard, Ann M.¹ (AUTHOR) annm.richard@gmail.com

المصدر: Journal of Cheminformatics. 10/5/2023, Vol. 15 Issue 1, p1-5. 5p.

مصطلحات موضوعية: *CHEMINFORMATICS, *WOMEN in science, *LANGUAGE models, *HUMAN fingerprints, *COMPUTATIONAL intelligence, *PHYSICAL sciences, *SESSION Initiation Protocol (Computer network protocol)

المؤلفون: Charest, Nathaniel¹ (AUTHOR) natemcharest@gmail.com

المصدر: Journal of Cheminformatics. 10/5/2023, Vol. 15 Issue 1, p1-4. 4p.

مصطلحات موضوعية: *DEEP learning, *CHEMINFORMATICS, *LANGUAGE models, *SCIENTIFIC method, *POOR people, *MACHINE learning

المؤلفون: Muralitharan, Dhivyadharshini¹ (AUTHOR), Varadharajan, Venkatramanan² (AUTHOR), Venkidasamy, Baskar³ (AUTHOR) baskarbt07@gmail.com

المصدر: Journal of Molecular Recognition. Oct2023, Vol. 36 Issue 10, p1-11. 11p.

مصطلحات موضوعية: *COVID-19 pandemic, *CHEMINFORMATICS, *PHARMACOLOGY, *COVID-19, *MANGOSTEEN, *GENE targeting