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LigTMap: ligand and structure-based target identification and activity prediction for small molecular compounds Journal article
Journal of Cheminformatics, 2021,Volume: 13,Issue: 1
Authors:  Shaikh, Faraz;  Tai, Hio Kuan;  Desai, Nirali;  Siu, Shirley W.I.
Favorite |  | TC[WOS]:2 TC[Scopus]:2 | Submit date:2021/12/09
Binding Affinity Prediction  Binding Interaction Fingerprint  Drug Repurposing  Fingerprint Similarity  Inverse Docking  Psovina  Random Forest  Target Prediction  
GWOVina: A grey wolf optimization approach to rigid and flexible receptor docking Journal article
Chemical Biology and Drug Design, 2021,Volume: 97,Issue: 1,Page: 97-110
Authors:  Wong, Kin Meng;  Tai, Hio Kuan;  Siu, Shirley W.I.
Favorite |  | TC[WOS]:7 TC[Scopus]:8 | Submit date:2021/12/07
Autodock Vina  Gwovina  Nature-inspired Algorithm  Protein–ligand Docking  Side-chain Flexibility  Structure-based Drug Design  Swarm Intelligence  
Deep-AmPEP30: Improve Short Antimicrobial Peptides Prediction with Deep Learning Journal article
Molecular Therapy - Nucleic Acids, 2020,Volume: 20,Page: 882-894
Authors:  Yan,Jielu;  Bhadra,Pratiti;  Li,Ang;  Sethiya,Pooja;  Qin,Longguang;  Tai,Hio Kuan;  Wong,Koon Ho;  Siu,Shirley W.I.
Favorite |  | TC[WOS]:51 TC[Scopus]:54 | Submit date:2021/03/04
Ampep  Ampicillin  Antimicrobial Peptide  Axpep  Candida Glabrata  Convolutional Neural Network  Drug Discovery  Machine Learning  Reduced Amino Acid Composition  
Chaos-embedded particle swarm optimization approach for protein-ligand docking and virtual screening Journal article
JOURNAL OF CHEMINFORMATICS, 2018,Volume: 10
Authors:  Tai, Hio Kuan;  Jusoh, Siti Azma;  Siu, Shirley W. I.
Favorite |  | TC[WOS]:13 TC[Scopus]:15 | Submit date:2019/01/17
Docking  Virtual Screening  Psovina  Autodock Vina  Chaotic Maps  Singer Map  Sinusoidal Map  
TMDIM: an improved algorithm for the structure prediction of transmembrane domains of bitopic dimers Journal article
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN, 2017,Volume: 31,Issue: 9,Page: 855-865
Authors:  Cao, Han;  Ng, Marcus C. K.;  Jusoh, Siti Azma;  Tai, Hio Kuan;  Siu, Shirley W. I.
Favorite |  | TC[WOS]:4 TC[Scopus]:3 | Submit date:2018/10/30
Structure Prediction  Bitopic Dimer  Helix Packing  Helix Assembly  Scwrl4  Bioinformatics