Optimization of the OPLS-AA Force Field for Long Hydrocarbons
Siu, Shirley W. I, Pluhackova, Kristyna, Böckmann, Rainer A
Published in Journal of chemical theory and computation (10.04.2012)
Published in Journal of chemical theory and computation (10.04.2012)
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Chemical toxicity prediction based on semi-supervised learning and graph convolutional neural network
Chen, Jiarui, Si, Yain-Whar, Un, Chon-Wai, Siu, Shirley W. I.
Published in Journal of cheminformatics (27.11.2021)
Published in Journal of cheminformatics (27.11.2021)
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Deep-AmPEP30: Improve Short Antimicrobial Peptides Prediction with Deep Learning
Yan, Jielu, Bhadra, Pratiti, Li, Ang, Sethiya, Pooja, Qin, Longguang, Tai, Hio Kuan, Wong, Koon Ho, Siu, Shirley W.I.
Published in Molecular therapy. Nucleic acids (05.06.2020)
Published in Molecular therapy. Nucleic acids (05.06.2020)
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Using Machine Learning Methods to Forecast Air Quality: A Case Study in Macao
Lei, Thomas M. T., Siu, Shirley W. I., Monjardino, Joana, Mendes, Luisa, Ferreira, Francisco
Published in Atmosphere (01.09.2022)
Published in Atmosphere (01.09.2022)
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Structure-Based in Silico Screening Identifies a Potent Ebolavirus Inhibitor from a Traditional Chinese Medicine Library
Shaikh, Faraz, Zhao, Yuguang, Alvarez, Luis, Iliopoulou, Maria, Lohans, Christopher, Schofield, Christopher J, Padilla-Parra, Sergi, Siu, Shirley W. I, Fry, Elizabeth E, Ren, Jingshan, Stuart, David I
Published in Journal of medicinal chemistry (28.03.2019)
Published in Journal of medicinal chemistry (28.03.2019)
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GWOVina: A grey wolf optimization approach to rigid and flexible receptor docking
Wong, Kin Meng, Tai, Hio Kuan, Siu, Shirley W. I.
Published in Chemical biology & drug design (01.01.2021)
Published in Chemical biology & drug design (01.01.2021)
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Journal Article
Biomolecular simulations of membranes: physical properties from different force fields
Siu, Shirley W I, Vácha, Robert, Jungwirth, Pavel, Böckmann, Rainer A
Published in The Journal of chemical physics (28.03.2008)
Published in The Journal of chemical physics (28.03.2008)
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Partners' experiences of living with men who have screening‐detected abdominal aortic aneurysms: A qualitative descriptive study
Ericsson, Anna, Carlson, Elisabeth, Ching, Shirley Siu‐yin, Molassiotis, Alex, Kumlien, Christine
Published in Journal of clinical nursing (01.10.2020)
Published in Journal of clinical nursing (01.10.2020)
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Indoleamine 2,3-dioxygenase and ischemic heart disease: a Mendelian Randomization study
Li, Mengyu, Kwok, Man Ki, Fong, Shirley Siu Ming, Schooling, Catherine Mary
Published in Scientific reports (11.06.2019)
Published in Scientific reports (11.06.2019)
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