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ReLink-PyB: an adapted REINVENT-based framework for non-DSM PfDHODH inhibitor discovery.

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Title: ReLink-PyB: an adapted REINVENT-based framework for non-DSM PfDHODH inhibitor discovery.
Authors: Thomas TV; Department of Physical Sciences, Amrita School of Engineering, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India., Thakur A; Department of Physical Sciences, Amrita School of Engineering, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India. t_amrita@blr.amrita.edu., Kumar SA; Department of Physical Sciences, Amrita School of Engineering, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India., Tom A; Department of Computer Science and Engineering, Amrita School of Computing, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India., Krishnan A; Department of Chemistry, St Berchmans College, Changanassery, 686101, Kerala, India., Nagaraja S; Department of Pharmaceutical Sciences, College of Clinical Pharmacy, King Faisal University, Al-Ahsa, 31982, Saudi Arabia. sharsha@kfu.edu.sa.
Source: Scientific reports [Sci Rep] 2026 Jun 29; Vol. 16 (1). Date of Electronic Publication: 2026 Jun 29.
Publication Type: Journal Article
Journal Info: Publisher: Nature Publishing Group Country of Publication: England NLM ID: 101563288 Publication Model: Electronic Cited Medium: Internet ISSN: 2045-2322 (Electronic) Linking ISSN: 20452322 NLM ISO Abbreviation: Sci Rep Subsets: MEDLINE; In Process
Database: MEDLINE Ultimate
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  Data: <searchLink fieldCode="AU" term="%22Thomas+TV%22">Thomas TV</searchLink>; Department of Physical Sciences, Amrita School of Engineering, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India.<br /><searchLink fieldCode="AU" term="%22Thakur+A%22">Thakur A</searchLink>; Department of Physical Sciences, Amrita School of Engineering, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India. t_amrita@blr.amrita.edu.<br /><searchLink fieldCode="AU" term="%22Kumar+SA%22">Kumar SA</searchLink>; Department of Physical Sciences, Amrita School of Engineering, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India.<br /><searchLink fieldCode="AU" term="%22Tom+A%22">Tom A</searchLink>; Department of Computer Science and Engineering, Amrita School of Computing, Amrita Vishwa Vidyapeetham, Bengaluru Campus, Carmelaram P.O, 560035, Bengaluru, India.<br /><searchLink fieldCode="AU" term="%22Krishnan+A%22">Krishnan A</searchLink>; Department of Chemistry, St Berchmans College, Changanassery, 686101, Kerala, India.<br /><searchLink fieldCode="AU" term="%22Nagaraja+S%22">Nagaraja S</searchLink>; Department of Pharmaceutical Sciences, College of Clinical Pharmacy, King Faisal University, Al-Ahsa, 31982, Saudi Arabia. sharsha@kfu.edu.sa.
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  Data: <searchLink fieldCode="JN" term="%22101563288%22">Scientific reports</searchLink> [Sci Rep] 2026 Jun 29; Vol. 16 (1). <i>Date of Electronic Publication: </i>2026 Jun 29.
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