These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

190 related articles for article (PubMed ID: 32110367)

  • 1. Datasets and their influence on the development of computer assisted synthesis planning tools in the pharmaceutical domain.
    Thakkar A; Kogej T; Reymond JL; Engkvist O; Bjerrum EJ
    Chem Sci; 2020 Jan; 11(1):154-168. PubMed ID: 32110367
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Machine Learning in Computer-Aided Synthesis Planning.
    Coley CW; Green WH; Jensen KF
    Acc Chem Res; 2018 May; 51(5):1281-1289. PubMed ID: 29715002
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Transfer Learning: Making Retrosynthetic Predictions Based on a Small Chemical Reaction Dataset Scale to a New Level.
    Bai R; Zhang C; Wang L; Yao C; Ge J; Duan H
    Molecules; 2020 May; 25(10):. PubMed ID: 32438572
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Automatic retrosynthetic route planning using template-free models.
    Lin K; Xu Y; Pei J; Lai L
    Chem Sci; 2020 Mar; 11(12):3355-3364. PubMed ID: 34122843
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Retrosynthetic accessibility score (RAscore) - rapid machine learned synthesizability classification from AI driven retrosynthetic planning.
    Thakkar A; Chadimová V; Bjerrum EJ; Engkvist O; Reymond JL
    Chem Sci; 2021 Jan; 12(9):3339-3349. PubMed ID: 34164104
    [TBL] [Abstract][Full Text] [Related]  

  • 6. SynRoute: A Retrosynthetic Planning Software.
    Latendresse M; Malerich JP; Herson J; Krummenacker M; Szeto J; Vu VA; Collins N; Madrid PB
    J Chem Inf Model; 2023 Sep; 63(17):5484-5495. PubMed ID: 37635298
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Improving Few- and Zero-Shot Reaction Template Prediction Using Modern Hopfield Networks.
    Seidl P; Renz P; Dyubankova N; Neves P; Verhoeven J; Wegner JK; Segler M; Hochreiter S; Klambauer G
    J Chem Inf Model; 2022 May; 62(9):2111-2120. PubMed ID: 35034452
    [TBL] [Abstract][Full Text] [Related]  

  • 8. On the use of real-world datasets for reaction yield prediction.
    Saebi M; Nan B; Herr JE; Wahlers J; Guo Z; Zurański AM; Kogej T; Norrby PO; Doyle AG; Chawla NV; Wiest O
    Chem Sci; 2023 May; 14(19):4997-5005. PubMed ID: 37206399
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Mining electronic laboratory notebooks: analysis, retrosynthesis, and reaction based enumeration.
    Christ CD; Zentgraf M; Kriegl JM
    J Chem Inf Model; 2012 Jul; 52(7):1745-56. PubMed ID: 22657734
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Retrosynthetic planning with experience-guided Monte Carlo tree search.
    Hong S; Zhuo HH; Jin K; Shao G; Zhou Z
    Commun Chem; 2023 Jun; 6(1):120. PubMed ID: 37301940
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Critical assessment of synthetic accessibility scores in computer-assisted synthesis planning.
    Skoraczyński G; Kitlas M; Miasojedow B; Gambin A
    J Cheminform; 2023 Jan; 15(1):6. PubMed ID: 36641473
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Folic acid supplementation and malaria susceptibility and severity among people taking antifolate antimalarial drugs in endemic areas.
    Crider K; Williams J; Qi YP; Gutman J; Yeung L; Mai C; Finkelstain J; Mehta S; Pons-Duran C; Menéndez C; Moraleda C; Rogers L; Daniels K; Green P
    Cochrane Database Syst Rev; 2022 Feb; 2(2022):. PubMed ID: 36321557
    [TBL] [Abstract][Full Text] [Related]  

  • 13. ExtractionScore: A Quantitative Framework for Evaluating Synthetic Routes on Predicted Liquid-Liquid Extraction Performance.
    Kuznetsov A; Sahinidis NV
    J Chem Inf Model; 2021 May; 61(5):2274-2282. PubMed ID: 33881866
    [TBL] [Abstract][Full Text] [Related]  

  • 14. MABAL: a Novel Deep-Learning Architecture for Machine-Assisted Bone Age Labeling.
    Mutasa S; Chang PD; Ruzal-Shapiro C; Ayyala R
    J Digit Imaging; 2018 Aug; 31(4):513-519. PubMed ID: 29404850
    [TBL] [Abstract][Full Text] [Related]  

  • 15. CompRet: a comprehensive recommendation framework for chemical synthesis planning with algorithmic enumeration.
    Shibukawa R; Ishida S; Yoshizoe K; Wasa K; Takasu K; Okuno Y; Terayama K; Tsuda K
    J Cheminform; 2020 Sep; 12(1):52. PubMed ID: 33431005
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Enhancing Retrosynthetic Reaction Prediction with Deep Learning Using Multiscale Reaction Classification.
    Baylon JL; Cilfone NA; Gulcher JR; Chittenden TW
    J Chem Inf Model; 2019 Feb; 59(2):673-688. PubMed ID: 30642173
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Predicting Retrosynthetic Reactions Using Self-Corrected Transformer Neural Networks.
    Zheng S; Rao J; Zhang Z; Xu J; Yang Y
    J Chem Inf Model; 2020 Jan; 60(1):47-55. PubMed ID: 31825611
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Synthetic cranial MRI from 3D optical surface scans using deep learning for radiation therapy treatment planning.
    Douglass M; Gorayski P; Patel S; Santos A
    Phys Eng Sci Med; 2023 Mar; 46(1):367-375. PubMed ID: 36752996
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Automated reaction database and reaction network analysis: extraction of reaction templates using cheminformatics.
    Plehiers PP; Marin GB; Stevens CV; Van Geem KM
    J Cheminform; 2018 Mar; 10(1):11. PubMed ID: 29524042
    [TBL] [Abstract][Full Text] [Related]  

  • 20. DFRscore: Deep Learning-Based Scoring of Synthetic Complexity with Drug-Focused Retrosynthetic Analysis for High-Throughput Virtual Screening.
    Kim H; Lee K; Kim C; Lim J; Kim WY
    J Chem Inf Model; 2024 Apr; 64(7):2432-2444. PubMed ID: 37651152
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 10.