249 related articles for article (PubMed ID: 30806519)
1. DataWarrior: an evaluation of the open-source drug discovery tool.
López-López E; Naveja JJ; Medina-Franco JL
Expert Opin Drug Discov; 2019 Apr; 14(4):335-341. PubMed ID: 30806519
[TBL] [Abstract][Full Text] [Related]
2. DataWarrior: an open-source program for chemistry aware data visualization and analysis.
Sander T; Freyss J; von Korff M; Rufener C
J Chem Inf Model; 2015 Feb; 55(2):460-73. PubMed ID: 25558886
[TBL] [Abstract][Full Text] [Related]
3. The impact of chemoinformatics on drug discovery in the pharmaceutical industry.
Martinez-Mayorga K; Madariaga-Mazon A; Medina-Franco JL; Maggiora G
Expert Opin Drug Discov; 2020 Mar; 15(3):293-306. PubMed ID: 31965870
[No Abstract] [Full Text] [Related]
4. ChemSuite: A package for chemoinformatics calculations and machine learning.
Tangadpalliwar SR; Vishwakarma S; Nimbalkar R; Garg P
Chem Biol Drug Des; 2019 May; 93(5):960-964. PubMed ID: 30637953
[TBL] [Abstract][Full Text] [Related]
5. Cheminformatics in Drug Discovery, an Industrial Perspective.
Chen H; Kogej T; Engkvist O
Mol Inform; 2018 Sep; 37(9-10):e1800041. PubMed ID: 29774657
[TBL] [Abstract][Full Text] [Related]
6. RISC: Rapid Inverted-Index Based Search of Chemical Fingerprints.
Vachery J; Ranu S
J Chem Inf Model; 2019 Jun; 59(6):2702-2713. PubMed ID: 30908028
[TBL] [Abstract][Full Text] [Related]
7. Cheminformatics to Characterize Pharmacologically Active Natural Products.
Medina-Franco JL; Saldívar-González FI
Biomolecules; 2020 Nov; 10(11):. PubMed ID: 33213003
[TBL] [Abstract][Full Text] [Related]
8. Progress on open chemoinformatic tools for expanding and exploring the chemical space.
Medina-Franco JL; Sánchez-Cruz N; López-López E; Díaz-Eufracio BI
J Comput Aided Mol Des; 2022 May; 36(5):341-354. PubMed ID: 34143323
[TBL] [Abstract][Full Text] [Related]
9. Open access in silico tools to predict the ADMET profiling of drug candidates.
Kar S; Leszczynski J
Expert Opin Drug Discov; 2020 Dec; 15(12):1473-1487. PubMed ID: 32735147
[TBL] [Abstract][Full Text] [Related]
10. Enalos Suite: New Cheminformatics Platform for Drug Discovery and Computational Toxicology.
Varsou DD; Nikolakopoulos S; Tsoumanis A; Melagraki G; Afantitis A
Methods Mol Biol; 2018; 1800():287-311. PubMed ID: 29934899
[TBL] [Abstract][Full Text] [Related]
11. ADMET profiling of geographically diverse phytochemical using chemoinformatic tools.
Fatima S; Gupta P; Sharma S; Sharma A; Agarwal SM
Future Med Chem; 2020 Jan; 12(1):69-87. PubMed ID: 31793338
[No Abstract] [Full Text] [Related]
12. Recent Advances in Machine-Learning-Based Chemoinformatics: A Comprehensive Review.
Niazi SK; Mariam Z
Int J Mol Sci; 2023 Jul; 24(14):. PubMed ID: 37511247
[TBL] [Abstract][Full Text] [Related]
13. BRADSHAW: a system for automated molecular design.
Green DVS; Pickett S; Luscombe C; Senger S; Marcus D; Meslamani J; Brett D; Powell A; Masson J
J Comput Aided Mol Des; 2020 Jul; 34(7):747-765. PubMed ID: 31637565
[TBL] [Abstract][Full Text] [Related]
14. Molecular Scaffold Hopping via Holistic Molecular Representation.
Grisoni F; Schneider G
Methods Mol Biol; 2021; 2266():11-35. PubMed ID: 33759119
[TBL] [Abstract][Full Text] [Related]
15. Learning to SMILES: BAN-based strategies to improve latent representation learning from molecules.
Wu CK; Zhang XC; Yang ZJ; Lu AP; Hou TJ; Cao DS
Brief Bioinform; 2021 Nov; 22(6):. PubMed ID: 34427296
[TBL] [Abstract][Full Text] [Related]
16. Galaxy for open-source computational drug discovery solutions.
Singh Gaur A; Nagamani S; Priyadarsinee L; Mahanta HJ; Parthasarathi R; Sastry GN
Expert Opin Drug Discov; 2023 Jun; 18(6):579-590. PubMed ID: 37089036
[TBL] [Abstract][Full Text] [Related]
17. Approaches for enhancing the analysis of chemical space for drug discovery.
Saldívar-González FI; Medina-Franco JL
Expert Opin Drug Discov; 2022 Jul; 17(7):789-798. PubMed ID: 35640229
[TBL] [Abstract][Full Text] [Related]
18. Artificial Intelligence and Cheminformatics-Guided Modern Privileged Scaffold Research.
Qiu HY; Clausen RP; He Y; Zhu HL
Curr Top Med Chem; 2021; 21(28):2593-2608. PubMed ID: 33982652
[TBL] [Abstract][Full Text] [Related]
19. Intelligently Applying Artificial Intelligence in Chemoinformatics.
Sharma S; Sharma D
Curr Top Med Chem; 2018; 18(20):1804-1826. PubMed ID: 30465503
[TBL] [Abstract][Full Text] [Related]
20. Using virtual reality for drug discovery: a promising new outlet for novel leads.
Liu XH; Wang T; Lin JP; Wu MB
Expert Opin Drug Discov; 2018 Dec; 13(12):1103-1114. PubMed ID: 30457399
[No Abstract] [Full Text] [Related]
[Next] [New Search]