Zobrazeno 1 - 10 of 18 pro vyhledávání: '"Jason S. E. Loo"'
2
Benchmarking the performance of MM/PBSA in virtual screening enrichment using the GPCR-Bench dataset
Autor: Jason S. E. Loo, Abigail L. Emtage, Mei Qian Yau
Publikováno v: Journal of Computer-Aided Molecular Design. 34:1133-1145
Recent breakthroughs in G protein-coupled receptor (GPCR) crystallography and the subsequent increase in number of solved GPCR structures has allowed for the unprecedented opportunity to utilize their experimental structures for structure-based drug
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a7e2f9eb3054b202600b7e3d4000b5e1
https://doi.org/10.1007/s10822-020-00339-5
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3
The effect of multiple simulation parameters on MM/PBSA performance for binding affinity prediction of CB1 cannabinoid receptor agonists and antagonists
Autor: Amelia Y. Y. Yong, Jason S. E. Loo, Yen Nee Yong
Publikováno v: Chemical Biology & Drug Design. 96:1244-1254
Both the inactive- and active-state CB1 receptor crystal structures have now been solved, allowing their application in various structure-based drug design methods. One potential method utilizing these crystal structures is the Molecular Mechanics/Po
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d3e7008c292ebba9cfb1aa535ebd0155
https://doi.org/10.1111/cbdd.13733
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5
Evaluating the performance of MM/PBSA for binding affinity prediction using class A GPCR crystal structures
Autor: Jason S. E. Loo, Stephen W. Doughty, Mei Qian Yau, Abigail L. Emtage, Nathaniel J. Y. Chan
Publikováno v: Journal of Computer-Aided Molecular Design. 33:487-496
The recent expansion of GPCR crystal structures provides the opportunity to assess the performance of structure-based drug design methods for the GPCR superfamily. Molecular Mechanics/Poisson-Boltzmann Surface Area (MM/PBSA)-based methods are commonl
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d1c29b37e7c892c5ef633823feff1e6a
https://doi.org/10.1007/s10822-019-00201-3
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6
Consensus scoring evaluated using the GPCR-Bench dataset: Reconsidering the role of MM/GBSA
Autor: Mei Qian, Yau, Jason S E, Loo
Publikováno v: Journal of computer-aided molecular design. 36(6)
The recent availability of large numbers of GPCR crystal structures has provided an unprecedented opportunity to evaluate their performance in virtual screening protocols using established benchmarking datasets. In this study, we evaluated the abilit
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=pmid________::f6e4fb257ce19c3f34eddad7267aac87
https://pubmed.ncbi.nlm.nih.gov/35581483
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7
An exploratory analysis of general practitioner prescribing patterns in Malaysia using a health insurance claims database
Autor: Wen Sing Su, Chun Mun Thum, Jason S E Loo
Publikováno v: The International journal of pharmacy practice. 30(1)
Objectives To determine the prescribing patterns and identify potentially inappropriate prescribing practices among general practitioners in the private primary care sector by analysing a large electronic health insurance claims database. Methods Med
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::db96f7746942331726a22a7bcf1f9116
https://pubmed.ncbi.nlm.nih.gov/34962576
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8
Induction of cell cycle arrest and apoptosis by copper complex Cu(SBCM)2 towards oestrogen-receptor positive MCF-7 breast cancer cells
Autor: Ji Hui Lim, Jason S. E. Loo, Yan Zhi Lor, Pau Xien Tan, Jhi Biau Foo, Yin Sim Tor, May Lee Low, Lee Chin Chan, Sze Wei Leong, Latifah Saiful Yazan, Chee Wun How, Chaw Yee Beh, Li Shan Ng
Publikováno v: RSC Advances. 9:18359-18370
Copper complexes have the potential to be developed as targeted therapy for cancer because cancer cells take up larger amounts of copper than normal cells. Copper complex Cu(SBCM)2 has been reported to induce cell cycle arrest and apoptosis towards t
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::1d2886c90c41a1bcd3e8b231b859d9e3
https://doi.org/10.1039/c9ra03130h
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9
Awareness of osteoporosis risk assessment tools and screening recommendations among community pharmacists in Malaysia
Autor: Jason S. E. Loo, Jezreel Francis, Renukha Sellappans, Li Shean Toh
Publikováno v: International journal of clinical pharmacy. 43(3)
Background The incidence of osteoporosis in Malaysia is increasing due to a fast-ageing population. Because of its silent nature, various osteoporosis risk assessment tools exist to detect high-risk patients and facilitate referrals for bone mineral
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::64c2c5efcfb911e6db5a3a854bde86eb
https://pubmed.ncbi.nlm.nih.gov/33507463
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10
Targeting cancer via Golgi α-mannosidase II inhibition: How far have we come in developing effective inhibitors?
Autor: Jason S. E. Loo, Mohd Fazli Mohammat, Jhi Biau Foo, Zheng Yang Lee, Agustono Wibowo
Publikováno v: Carbohydrate Research. 508:108395
Dysregulation of glycosylation pathways has been well documented in several types of cancer, where it often participates in cancer development and progression, especially cancer metastasis. Hence, inhibition of glycosidases such as mannosidases can d
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7a47b1777e7dcd0597b4b7efaacf769b
https://doi.org/10.1016/j.carres.2021.108395
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