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1دورية أكاديمية
المؤلفون: Elmeri M. Jokinen, Miika Niemeläinen, Sami T. Kurkinen, Jukka V. Lehtonen, Sakari Lätti, Pekka A. Postila, Olli T. Pentikäinen, Sanna P. Niinivehmas
المصدر: Molecules; Volume 28; Issue 8; Pages: 3420
مصطلحات موضوعية: molecular docking, docking rescoring, negative image-based rescoring (R-NiB), brute force negative image-based optimization (BR-NiB), pharmacophore (PHA) filtering, retinoic acid receptor-related orphan receptor gamma t (RORγt), virtual screening (VS), inflammation
جغرافية الموضوع: agris
وصف الملف: application/pdf
العلاقة: Medicinal Chemistry; https://dx.doi.org/10.3390/molecules28083420Test
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2دورية أكاديمية
المصدر: International Journal of Molecular Sciences; Volume 23; Issue 14; Pages: 7871
مصطلحات موضوعية: molecular docking, docking rescoring, virtual screening, negative image-based rescoring (R-NiB), brute-force negative image-based optimization (BR-NiB), ligand-enhanced brute-force negative image-based optimization (LBR-NiB), pharmacophore modelling
جغرافية الموضوع: agris
وصف الملف: application/pdf
العلاقة: Molecular Pharmacology; https://dx.doi.org/10.3390/ijms23147871Test
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3دورية أكاديمية
المؤلفون: Kurkinen, Sami, Lehtonen, Jukka V., Pentikäinen, Olli, Postila, Pekka
المصدر: Kurkinen , S , Lehtonen , J V , Pentikäinen , O & Postila , P 2022 , ' Ligand-Enhanced Negative Images Optimized for Docking Rescoring ' , International Journal of Molecular Sciences , vol. 23 , no. 14 . https://doi.org/10.3390/ijms23147871Test
مصطلحات موضوعية: Molecular docking, Docking rescoring, Pharmacophore modelling, Virtual screening
وصف الملف: application/pdf
الإتاحة: https://doi.org/10.3390/ijms23147871Test
https://research.abo.fi/en/publications/07fbe784-e47a-4ef0-8b71-58db33665f31Test
https://research.abo.fi/ws/files/49793477/ijms_23_07871_v2.pdfTest
https://urn.fi/URN:NBN:fi-fe2023030329414Test -
4دورية أكاديمية
المؤلفون: Mira Ahinko, Sami T. Kurkinen, Sanna P. Niinivehmas, Olli T. Pentikäinen, Pekka A. Postila
المصدر: International Journal of Molecular Sciences; Volume 20; Issue 11; Pages: 2779
مصطلحات موضوعية: negative image-based (NIB) screening, negative image-based rescoring (R-NiB), molecular docking, rigid docking, docking rescoring, virtual screening, structure-based drug discovery, cyclooxygenase-2 (COX-2)
جغرافية الموضوع: agris
وصف الملف: application/pdf
العلاقة: Molecular Biophysics; https://dx.doi.org/10.3390/ijms20112779Test
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5دورية أكاديمية
مصطلحات موضوعية: cyclooxygenase-2 (COX-2), docking rescoring, molecular docking, negative image-based (NIB) screening, negative image-based rescoring (R-NiB), rigid docking, structure-based drug discovery, virtual screening, molekyylilääketiede, lääkesuunnittelu, entsyymit, ligandit
وصف الملف: application/pdf; fulltext
العلاقة: International Journal of Molecular Sciences; 11; 20; Ahinko, M., Kurkinen, S., Niinivehmas, S., Pentikäinen, O., & Postila, P. (2019). A Practical Perspective : The Effect of Ligand Conformers on the Negative Image-Based Screening. International Journal of Molecular Sciences , 20 (11), Article 2779. https://doi.org/10.3390/ijms20112779Test; CONVID_31222556; TUTKAID_81710; URN:NBN:fi:jyu-201906183266; http://urn.fi/URN:NBN:fi:jyu-201906183266Test
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6دورية أكاديمية
المؤلفون: Sami T. Kurkinen, Sanna Niinivehmas, Mira Ahinko, Sakari Lätti, Olli T. Pentikäinen, Pekka A. Postila
المصدر: Frontiers in Pharmacology, Vol 9 (2018)
مصطلحات موضوعية: molecular docking, docking rescoring, negative image-based rescoring (R-NiB), benchmarking, consensus scoring, Therapeutics. Pharmacology, RM1-950
وصف الملف: electronic resource
العلاقة: http://journal.frontiersin.org/article/10.3389/fphar.2018.00260/fullTest; https://doaj.org/toc/1663-9812Test
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7دورية أكاديمية
المؤلفون: Kurkinen, Sami, Niinivehmas, Sanna, Ahinko, Mira, Lätti, Sakari, Pentikäinen, Olli, Postila, Pekka
مصطلحات موضوعية: molecular docking, docking rescoring, negative image-based rescoring (R-NiB), consensus scoring, molekyylilääketiede, benchmarking
وصف الملف: application/pdf
العلاقة: Frontiers in Pharmacology; March; Kurkinen, S., Niinivehmas, S., Ahinko, M., Lätti, S., Pentikäinen, O., & Postila, P. (2018). Improving Docking Performance Using Negative Image-Based Rescoring. Frontiers in Pharmacology , 9 (March), Article 260. https://doi.org/10.3389/fphar.2018.00260Test; CONVID_27969553; TUTKAID_77174; URN:NBN:fi:jyu-201803271858; http://urn.fi/URN:NBN:fi:jyu-201803271858Test
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المصدر: International Journal of Molecular Sciences; Volume 23; Issue 14; Pages: 7871
مصطلحات موضوعية: molecular docking, docking rescoring, virtual screening, negative image-based rescoring (R-NiB), brute-force negative image-based optimization (BR-NiB), ligand-enhanced brute-force negative image-based optimization (LBR-NiB), pharmacophore modelling
وصف الملف: application/pdf
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=multidiscipl::53dce398569183ade3eb7a3427f3ba4aTest
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9
المؤلفون: Sami T. Kurkinen, Sanna Niinivehmas, Mira Ahinko, Sakari Lätti, Olli T. Pentikäinen, Pekka A. Postila
مصطلحات موضوعية: Pharmacology, Basic Pharmacology, Clinical Pharmacology and Therapeutics, Clinical Pharmacy and Pharmacy Practice, Pharmaceutical Sciences, Pharmacogenomics, Toxicology (incl. Clinical Toxicology), Pharmacology and Pharmaceutical Sciences not elsewhere classified, molecular docking, docking rescoring, negative image-based rescoring (R-NiB), benchmarking, consensus scoring
الإتاحة: https://doi.org/10.3389/fphar.2018.00260.s001Test
https://figshare.com/articles/dataset/DataSheet1_zip/6026003Test