PHASTEST: faster than PHASTER, better than PHAST von Wishart, David S, Han, Scott, Saha, Sukanta, Oler, Eponine, Peters, Harrison, Grant, Jason R, Stothard, Paul, Gautam, Vasuk

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BioTransformer 3.0—a web server for accurately predicting metabolic transformation products von Wishart, David S, Tian, Siyang, Allen, Dana, Oler, Eponine, Peters, Harrison, Lui, Vicki W, Gautam, Vasuk, Djoumbou-Feunang, Yannick, Greiner, Russell, Metz, Thomas O

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CFM-ID 4.0 – a web server for accurate MS-based metabolite identification von Wang, Fei, Allen, Dana, Tian, Siyang, Oler, Eponine, Gautam, Vasuk, Greiner, Russell, Metz, Thomas O, Wishart, David S

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MagMet: A fully automated web server for targeted nuclear magnetic resonance metabolomics of plasma and serum von Rout, Manoj, Lipfert, Matthias, Lee, Brian L., Berjanskii, Mark, Assempour, Nazanin, Fresno, Rosa Vazquez, Cayuela, Arnau Serra, Dong, Ying, Johnson, Mathew, Shahin, Honeya, Gautam, Vasuk, Sajed, Tanvir, Oler, Eponine, Peters, Harrison, Mandal, Rupasri, Wishart, David S.

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Accurate Prediction of 1H NMR Chemical Shifts of Small Molecules Using Machine Learning von Sajed, Tanvir, Sayeeda, Zinat, Lee, Brian L., Berjanskii, Mark, Wang, Fei, Gautam, Vasuk, Wishart, David S.

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Year-Long Stability of Nucleic Acid Bases in Concentrated Sulfuric Acid: Implications for the Persistence of Organic Chemistry in Venus' Clouds von Seager, Sara, Petkowski, Janusz J, Seager, Maxwell D, Grimes, Jr, John H, Zinsli, Zachary, Vollmer-Snarr, Heidi R, Abd El-Rahman, Mohamed K, Wishart, David S, Lee, Brian L, Gautam, Vasuk, Herrington, Lauren, Bains, William, Darrow, Charles

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HMDB 5.0: the Human Metabolome Database for 2022 von Wishart, David S, Guo, AnChi, Oler, Eponine, Wang, Fei, Anjum, Afia, Peters, Harrison, Dizon, Raynard, Sayeeda, Zinat, Tian, Siyang, Lee, Brian L, Berjanskii, Mark, Mah, Robert, Yamamoto, Mai, Jovel, Juan, Torres-Calzada, Claudia, Hiebert-Giesbrecht, Mickel, Lui, Vicki W, Varshavi, Dorna, Varshavi, Dorsa, Allen, Dana, Arndt, David, Khetarpal, Nitya, Sivakumaran, Aadhavya, Harford, Karxena, Sanford, Selena, Yee, Kristen, Cao, Xuan, Budinski, Zachary, Liigand, Jaanus, Zhang, Lun, Zheng, Jiamin, Mandal, Rupasri, Karu, Naama, Dambrova, Maija, Schiöth, Helgi B, Greiner, Russell, Gautam, Vasuk

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Accurate prediction of isothermal gas chromatographic Kováts retention indices von Anjum, Afia, Liigand, Jaanus, Milford, Ralph, Gautam, Vasuk, Wishart, David S.

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MiMeDB: the Human Microbial Metabolome Database von Wishart, David S, Oler, Eponine, Peters, Harrison, Guo, AnChi, Girod, Sagan, Han, Scott, Saha, Sukanta, Lui, Vicki W, LeVatte, Marcia, Gautam, Vasuk, Kaddurah-Daouk, Rima, Karu, Naama

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DrugBank 6.0: the DrugBank Knowledgebase for 2024 von Knox, Craig, Wilson, Mike, Klinger, Christen M, Franklin, Mark, Oler, Eponine, Wilson, Alex, Pon, Allison, Cox, Jordan, Chin, Na Eun (Lucy), Strawbridge, Seth A, Garcia-Patino, Marysol, Kruger, Ray, Sivakumaran, Aadhavya, Sanford, Selena, Doshi, Rahil, Khetarpal, Nitya, Fatokun, Omolola, Doucet, Daphnee, Zubkowski, Ashley, Rayat, Dorsa Yahya, Jackson, Hayley, Harford, Karxena, Anjum, Afia, Zakir, Mahi, Wang, Fei, Tian, Siyang, Lee, Brian, Liigand, Jaanus, Peters, Harrison, Wang, Ruo Qi (Rachel), Nguyen, Tue, So, Denise, Sharp, Matthew, da Silva, Rodolfo, Gabriel, Cyrella, Scantlebury, Joshua, Jasinski, Marissa, Ackerman, David, Jewison, Timothy, Sajed, Tanvir, Gautam, Vasuk, Wishart, David S

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GCMS-ID: a webserver for identifying compounds from gas chromatography mass spectrometry experiments von Wakoli, Julia, Anjum, Afia, Sajed, Tanvir, Oler, Eponine, Wang, Fei, Gautam, Vasuk, LeVatte, Marcia, Wishart, David S

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An In Silico Infrared Spectral Library of Molecular Ions for Metabolite Identification von Houthuijs, Kas J., Berden, Giel, Engelke, Udo F. H., Gautam, Vasuk, Wishart, David S., Wevers, Ron A., Martens, Jonathan, Oomens, Jos

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Chemical Composition of Commercial Cannabis von Wishart, David S., Hiebert-Giesbrecht, Mickel, Inchehborouni, Gozal, Cao, Xuan, Guo, An Chi, LeVatte, Marcia A., Torres-Calzada, Claudia, Gautam, Vasuk, Johnson, Mathew, Liigand, Jaanus, Wang, Fei, Zahraei, Shirin, Bhumireddy, Sudarshana, Wang, Yilin, Zheng, Jiamin, Mandal, Rupasri, Dyck, Jason R. B.

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PlasMapper 3.0—a web server for generating, editing, annotating and visualizing publication quality plasmid maps von Wishart, David S, Ren, Leah, Leong-Sit, Jacques, Saha, Sukanta, Grant, Jason R, Stothard, Paul, Singh, Upasana, Kropielnicki, Abby, Oler, Eponine, Peters, Harrison, Gautam, Vasuk

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Deep Learning-Enabled MS/MS Spectrum Prediction Facilitates Automated Identification Of Novel Psychoactive Substances von Wang, Fei, Pasin, Daniel, Skinnider, Michael A., Liigand, Jaanus, Kleis, Jan-Niklas, Brown, David, Oler, Eponine, Sajed, Tanvir, Gautam, Vasuk, Harrison, Stephen, Greiner, Russell, Foster, Leonard J., Dalsgaard, Petur Weihe, Wishart, David S.

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MarkerDB 2.0: a comprehensive molecular biomarker database for 2025 von Jackson, Hayley, Oler, Eponine, Torres-Calzada, Claudia, Kruger, Ray, Hira, Amandeep Singh, López-Hernández, Yamilé, Pandit, Devanshi, Wang, Jiaxuan, Yang, Kellie, Fatokun, Omolola, Berjanskii, Mark, MacKay, Scott, Sajed, Tanvir, Han, Scott, Woudstra, Robyn, Sykes, Gina, Poelzer, Jenna, Sivakumaran, Aadhavya, Gautam, Vasuk, Wong, Gane, Wishart, David S

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PathBank 2.0—the pathway database for model organism metabolomics von Wishart, David S, Kruger, Ray, Sivakumaran, Aadhavya, Harford, Karxena, Sanford, Selena, Doshi, Rahil, Khetarpal, Nitya, Fatokun, Omolola, Doucet, Daphnee, Zubkowski, Ashley, Jackson, Hayley, Sykes, Gina, Ramirez-Gaona, Miguel, Marcu, Ana, Li, Carin, Yee, Kristen, Garros, Christiana, Rayat, Dorsa Yahya, Coleongco, Jeanne, Nandyala, Tharuni, Gautam, Vasuk, Oler, Eponine

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Stability of nucleic acid bases in concentrated sulfuric acid: Implications for the habitability of Venus' clouds von Seager, Sara, Petkowski, Janusz J, Seager, Maxwell D, Grimes, Jr, John H, Zinsli, Zachary, Vollmer-Snarr, Heidi R, Abd El-Rahman, Mohamed K, Wishart, David S, Lee, Brian L, Gautam, Vasuk, Herrington, Lauren, Bains, William, Darrow, Charles

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NP-MRD: the Natural Products Magnetic Resonance Database von Wishart, David S, Sayeeda, Zinat, Budinski, Zachary, Guo, AnChi, Lee, Brian L, Berjanskii, Mark, Rout, Manoj, Peters, Harrison, Dizon, Raynard, Mah, Robert, Torres-Calzada, Claudia, Hiebert-Giesbrecht, Mickel, Varshavi, Dorna, Varshavi, Dorsa, Oler, Eponine, Allen, Dana, Cao, Xuan, Gautam, Vasuk, Maras, Andrew, Poynton, Ella F, Tavangar, Pegah, Yang, Vera, van Santen, Jeffrey A, Ghosh, Rajarshi, Sarma, Saurav, Knutson, Eleanor, Sullivan, Victoria, Jystad, Amy M, Renslow, Ryan, Sumner, Lloyd W, Linington, Roger G, Cort, John R

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Accurate Prediction of 1 H NMR Chemical Shifts of Small Molecules Using Machine Learning von Sajed, Tanvir, Sayeeda, Zinat, Lee, Brian L, Berjanskii, Mark, Wang, Fei, Gautam, Vasuk, Wishart, David S

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