Latest Research Publications - Life Science Network

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Created 16 Sep 2026

Quantum-machine-assisted drug discovery.

by Yidong Zhou, Jintai Chen, Jinglei Cheng, Xu Cao, Yuanyuan Zhang, Gopal Karemore, Marinka Zitnik, Frederic T Chong, Junyu Liu, Tianfan Fu, Zhiding Liang — npj drug discovery. Volume 3(1). Jan 07, 2026.
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Created 16 Sep 2026

Large Language Model Agent for Modular Task Execution in Drug Discovery.

by Janghoon Ock, Radheesh Sharma Meda, Srivathsan Badrinarayanan, Neha S Aluru, Achuth Chandrasekhar, Amir Barati Farimani — Journal of chemical information and modeling. Volume 66(4): 2055-2068. Feb 23, 2026.
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Created 16 Sep 2026

Novel molecular design via a scaffold-aware transformer with multi-scale attention mechanisms.

by Junyoung Park, Sunyong Yoo — Journal of cheminformatics. Volume 18(1). May 19, 2026.
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Created 16 Sep 2026

Synthesizability via reward engineering: expanding generative molecular design into synthetic space.

by Dominik Dekleva, Alexey Voronov, Jon Paul Janet, Albin Ekborg, Jure Borišek, Martina H Rambaher, Hannes H Loeffler — Chemical science. Volume 17(20): 10015-10028. May 27, 2026.
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Created 16 Sep 2026

SurroDock: A Deep Learning Surrogate for Accelerated Pre-Docking Ligand Prioritization in Structure-Based Virtual Screening.

by Jongkeun Choi — International journal of molecular sciences. Volume 27(15). Jul 26, 2026.
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Created 16 Sep 2026

VeGA-RX and VeGA-SCX: Controllable SMARTS-Guided Generative Transformers for Precision-Driven De Novo Drug Design.

by Pietro Delre, Giada Bellofatto, Antonio Lavecchia — Journal of chemical information and modeling. Volume 66(9): 5189-5205. May 11, 2026.
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Created 16 Sep 2026

A Reinforcement Learning-Guided Genetic Algorithm Integrating Medicinal Chemistry-Inspired Molecular Transformations.

by Domenico Alberga, Vittoria Nanna, Maria Giovanna Eva Papadopoulos, Adolfo Ancona, Maria Cristina Lomuscio, Giuseppe Felice Mangiatordi — Journal of chemical information and modeling. Volume 66(8): 4576-4591. Apr 27, 2026.
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Created 16 Sep 2026

Small Intestinal Bacterial Overgrowth and Intestinal Methanogen Overgrowth: Are They Overdiagnosed?

by Anokhi S Kholwadwala, Eamonn M M Quigley — Acta gastroenterologica Latinoamericana. Volume 55(4): 276-291. Epub Dec 23, 2025.
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Created 16 Sep 2026

Clinical Utility and Diagnostic Yield of Duodenal Versus Jejunal Aspirates for Small Intestinal Bacterial or Fungal Overgrowth.

by Pearl Princess Uy, Karlo Fidel, Jing Sun, Anabel Liyen Cartelle, Satish S C Rao — Digestive diseases and sciences. Jul 18, 2026.
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Created 16 Sep 2026

The p53 Isoforms as Potential Biomarkers in Different Cancer Entities.

by Christine Supina Pavić, Anđela Horvat, Ana Tadijan, Janja Josić, Martina Deželjin, Maja Jazvinšćak Jembrek, Ignacija Vlašić, Neda Slade — International journal of molecular sciences. Volume 27(12). Jun 06, 2026.
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Publications

Heads up!

Quantum-machine-assisted drug discovery.

Large Language Model Agent for Modular Task Execution in Drug Discovery.

Novel molecular design via a scaffold-aware transformer with multi-scale attention mechanisms.

Synthesizability via reward engineering: expanding generative molecular design into synthetic space.

SurroDock: A Deep Learning Surrogate for Accelerated Pre-Docking Ligand Prioritization in Structure-Based Virtual Screening.

VeGA-RX and VeGA-SCX: Controllable SMARTS-Guided Generative Transformers for Precision-Driven De Novo Drug Design.

A Reinforcement Learning-Guided Genetic Algorithm Integrating Medicinal Chemistry-Inspired Molecular Transformations.

Small Intestinal Bacterial Overgrowth and Intestinal Methanogen Overgrowth: Are They Overdiagnosed?

Clinical Utility and Diagnostic Yield of Duodenal Versus Jejunal Aspirates for Small Intestinal Bacterial or Fungal Overgrowth.

The p53 Isoforms as Potential Biomarkers in Different Cancer Entities.