Publications

Anna Castro, Jamie Bernadette Sy, Stephani Joy Macalino, Nadia Morales, Princess Alyssa Abid, Junie Billones, Maria Constancia Carrillo (2022). Computer-aided screening for potential inhibitory compounds against a Klebsiella pneumoniae local isolate containing SHV-1 and CTX-M antibiotic resistance genes. Philippine Journal of Health Research and Development.

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Michael Russelle S Alvarez, Junie Billones, Chun-Hung Lin, Francisco Heralde, others (2021). Plectranthus amboinicus (Spreng.) Semi-purified Fractions with Selective $β$-Glucuronidase Inhibition Elucidated with gas chromatography-mass spectrometry and in silico docking. Pharmacognosy Magazine.

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Liza T Billones, Nadia B Morales, Junie B Billones (2021). Logistic regression and random forest unveil key molecular descriptors of druglikeness. Chem-Bio Informatics Journal.

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Junie B Billones, Nina Abigail B Clavio (2021). In Silico Discovery of Natural Products Against Dengue RNA-Dependent RNA Polymerase Drug Target. Chem-Bio Informatics Journal.

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Arra B Asejo, Patrick G Moreno, Junie Billones, Ruel Nacario, Francisco M Heralde III (2020). Preliminary characterization and in silico studies on the alpha-amylase inhibitors from Momordica charantia AMP06 methanolic leaf extract. Philippine Journal of Biochemistry and Molecular Biology.

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Jasper Kyle Catapang, Junie B Billones (2020). On the generation of novel ligands for SARS-CoV-2 protease and ACE2 receptor via constrained graph variational autoencoders.

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Jerwin Jay E Taping, Junie B Billones, VOLTAIRE G ORGANO (2020). Influence of Varying Functionalization on the Peroxidase Activity of Nickel (II)--Pyridine Macrocycle Catalysts: Mechanistic Insights from Density Functional Theory. Computation.

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STEPHANI JOY Y MACALINO, Junie B Billones, VOLTAIRE G ORGANO, MARIA CONSTANCIA O CARRILLO (2020). In silico strategies in tuberculosis drug discovery. Molecules.

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Charlaine A Aventurado, Junie B Billones, Ross D Vasquez, Agnes L Castillo (2020). In ovo and in silico evaluation of the anti-angiogenic potential of syringin. Drug Design, Development and Therapy.

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Junie B Billones, Charissma Leiah R Ragasa (2019). Virtual Screening of Natural Products and Drugs as Inhibitors against Aspartate Transcarbamoylase and Orotidine-5'-Monophosphate Decarboxylase inP lasmodium falciparum. Philippine Journal of Health Research and Development.

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Junie B Billones, Marielle Alyanna T Bangalan (2019). Structure-based discovery of inhibitors against MurE in methicillin-resistant Staphylococcus aureus. Oriental Journal of Chemistry.

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Lech Havel Orquin Tizon, Marielle Alyanna T Bangalan, Junie B Billones (2019). Mutations L163P and R190C in NKX2-5 Confer More Stability to the Protein's Binding to DNA. The FASEB Journal.

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Liza T Billones, Alex C Gonzaga, Junie B Billones (2019). Molecular descriptors for drugs: A discriminant analysis. Phil J Health Res Devel.

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Honeymae C Alos, Junie B Billones, Ross D Vasquez, Agnes L Castillo (2019). Antiangiogenesis Potential of Alpinumisoflavone as an Inhibitor of Matrix Metalloproteinase-9 (MMP-9) and Vascular Endothelial Growth Factor Receptor-2 (VEGFR-2). Current Enzyme Inhibition.

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Peñafrancia D Rariza, Junie B Billones (2018). Retusenol Potentially Inhibits Putative Drug Targets for Tuberculosis, Cardiovascular Diseases, Cancer and HIV: A Reverse Docking Study. Oriental Journal of Chemistry.

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MJA Bernaldez, JB Billones, A Magpantay (2018). In silico analysis of binding interactions between GSK983 and human DHODH through docking and molecular dynamics. AIP Conference Proceedings.

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Liza T Billones, Junie B Billones (2017). Randic Shape and Size Indices Account for the Variability in Xanthine Oxidase Inhibitory Activity of a Family of Fused Pyrans. Oriental Journal of Chemistry.

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Junie B Billones, MARIA CONSTANCIA O CARRILLO, VOLTAIRE G ORGANO, JAMIE BERNADETTE A SY, Nina Abigail B Clavio, STEPHANI JOY Y MACALINO, INNO A EMNACEN, Alexandra P Lee, Paul Kenny L Ko, Gisela P Concepcion (2017). In silico discovery and in vitro activity of inhibitors against Mycobacterium tuberculosis 7, 8-diaminopelargonic acid synthase (Mtb BioA). Drug design, development and therapy.

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Liza T Billones, Junie B Billones (2017). Deciphering the Calculated QSAR Properties of Polyaryl Compounds that Influence their Xanthine Oxidase Inhibition Using Discriminant Analysis. Philippine Journal of Health Research and Development.

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Junie B Billones, MARIA CONSTANCIA O CARRILLO, VOLTAIRE G ORGANO, STEPHANI JOY Y MACALINO, JAMIE BERNADETTE A SY, INNO A EMNACEN, Nina Abigail B Clavio, Gisela P Concepcion (2016). Toward antituberculosis drugs: in silico screening of synthetic compounds against Mycobacterium tuberculosis l, d-transpeptidase 2. Drug Design, Development and Therapy.

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Edward Gabrielle V Hilvano, Guang Yang, INNO A EMNACEN, Elena V Rybak-Akimova, Junie B Billones, MARIA CONSTANCIA O CARRILLO, Bruce C Noll, VOLTAIRE G ORGANO (2016). Synthesis and crystal structure of [2, 7, 12-trimethyl-3, 7, 11, 17-tetraazabicyclo [11.3. 1] heptadeca-1 (17), 13, 15-triene-$ąppa$4N] copper (II) bis (perchlorate). Acta Crystallographica Section E: Crystallographic Communications.

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Junie B Billones (2016). Reverse docking study unravels the potential Mycobacterium tuberculosis enzyme targets of Agelasine F. Orient J Chem.

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ABDUL-RASHID B SAMPACO Iii, Junie B Billones (2015). Virtual screening of natural products, molecular docking and dynamics simulations on M. tuberculosis S-adenosyl-L-homocysteine hydrolase. Orient J Chem.

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Junie B Billones, Ariane Marielle F Valle, Erika A Macalalad, Joanna Liezl A Abrina, Ernest Jay V Cafino, Thatcher M Pancho (2015). Virtual Screening for Possible Allosteric Inhibitors of Dengue RNA-dependent RNA polymerase (RdRp). Philippine Journal of Health Research and Development.

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Junie B Billones, Eva Marie A Ratilla, Graham A Heath (2015). Variation of electrode potential and charge transfer bands in series of tetravalent ruthenium complexes [RuCl6- n (PrCN) n] n- 2. Inorganica Chimica Acta.

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Kakai Bellaliza Juban, Junie Billones (2015). Simultaneous Electrochemical Determination of Hypoxanthine and Xanthine by Poly(Threonine) Film-Modified Electrode. Analytical & Bioanalytical Electrochemistry.

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Dmitri Leo Cordova, Rachelle Jenine Abuel, Maynard Galingana, Lemuel Villanueva, Junie Billones (2015). Piggyback drug development: Molecular docking of Entacapone analogues as direct M. tuberculosis InhA inhibitors. Journal of Chemical and Pharmaceutical Research.

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Viktoria Shade Vios, Junie Billones (2015). Cluster and multi-linear regression analyses guided identification of molecular descriptors that account for cyclooxygenase activities. Journal of Chemical and Pharmaceutical Research.

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Nina Abigail B Clavio, Junie B Billones (2014). Virtual screening against Mycobacterium tuberculosis isocitrate lyase and in silico ADME-Tox evaluation of top hits. J Chem Pharm Res.

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Junie Billones, Maria C Carrillo, Voltaire Organo, Stephani J Macalino, Inno Emnacen, Jamie B Sy (2014). Virtual screening against M. tuberculosis 7, 8-diaminopelargonic acid synthase (MtbBioA) and in silico toxicity evaluation of top hits. Current Enzyme Inhibition.

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Junie B Billones, Ariane Marielle F Valle (2014). Structure-Based Design of Inhibitors Against Maltosyltransferase GlgE. Oriental Journal of Chemistry.

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Liza Billones, Junie Billones (2014). A univariate analysis of molecular properties and inhibitory activity of dihydrothiophenones against dihydroorotate dehydrogenase of malaria parasite. Journal of Chemical and Pharmaceutical Research.

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Junie B Billones, MARIA CONSTANCIA O CARRILLO, VOLTAIRE G ORGANO, STEPHANI JOY Y MACALINO, INNO A EMNACEN, JAMIE BERNADETTE A SY (2013). Virtual Screening against Mycobacterium tuberculosis Lipoate Protein Ligase B (MtbLipB) and In Silico ADMET Evaluation of Top Hits.

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Andrea Marie M Reyes, Junie B Billones (2013). Quantitative structure-activity relationship study of curcumin analogues as anti-proliferative agents of human prostate cancer cell line (PC-3). Kimika.

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LT Billones, JB Billones (2013). Multiple linear regression model of Shiga toxin inhibitory activity of dihydroquinazolinone derivatives of Retro-2cycl. Philippine Science Letters.

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Vivien Cherie C Uy, Junie B Billones (2012). Towards antituberculosis drugs: virtual screening for potential inhibitors of pantothenate synthetase of Mycobacterium tuberculosis. Phil Sci Lett.

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Catrina Theresa M Yang, Junie B Billones (2012). Towards antituberculosis drugs: molecular docking of curcumin and its analogues to pantothenate synthetase. Phil J Sci.

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Junie B Billones, Eva Marie A Ratilla, Graham A Heath (2011). Variation in both metal and ligand frontier orbital levels in series of [RuCl6- n (PrCN) n] z (n= 0--6) complexes. Inorganic Chemistry Communications.

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Junie B Billones, Salvador M Buenaobra (2011). QSAR Study of Cyclooxygenase-2 (COX-2) Inhibitors. Philippine Journal of Science.

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Reiner G Villavicencio, Junie B Billones (2009). Computational Studies of Dipyridodiazepinones as Human Immunodeficiency Virus (HIV) Reverse Transcriptase Inhibitors. Philippine Journal of Science.

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Custer C Deocaris, Alejandro Q Nato Jr (2001). Nuclear energy in the post-genomic era.

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Junie B Billones, Eva Marie A Ratilla, Graham A Heath (2000). Non-additive Ligand Effects in Series of L-Substituted Ruthenium Halide Complexes (L= CH3CN, AsMe3, CO). Kimika.

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