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.
319 related articles for article (PubMed ID: 32234678)
1. Ligand and structure based virtual screening of chemical databases to explore potent small molecule inhibitors against breast invasive carcinoma using recent computational technologies. Agarwal S; Dixit A; Kashaw SK J Mol Graph Model; 2020 Jul; 98():107591. PubMed ID: 32234678 [TBL] [Abstract][Full Text] [Related]
2. Potential target identification for breast cancer and screening of small molecule inhibitors: A bioinformatics approach. Agarwal S; Kashaw SK J Biomol Struct Dyn; 2021 Apr; 39(6):1975-1989. PubMed ID: 32186248 [TBL] [Abstract][Full Text] [Related]
3. An integrated computational approach of molecular dynamics simulations, receptor binding studies and pharmacophore mapping analysis in search of potent inhibitors against tuberculosis. Agarwal S; Verma E; Kumar V; Lall N; Sau S; Iyer AK; Kashaw SK J Mol Graph Model; 2018 Aug; 83():17-32. PubMed ID: 29753941 [TBL] [Abstract][Full Text] [Related]
4. Discovery of novel natural compound inhibitors targeting estrogen receptor α by an integrated virtual screening strategy. Yu E; Xu Y; Shi Y; Yu Q; Liu J; Xu L J Mol Model; 2019 Aug; 25(9):278. PubMed ID: 31463793 [TBL] [Abstract][Full Text] [Related]
5. Designing and optimization of novel human LMTK3 inhibitors against breast cancer - a computational approach. Anbarasu K; Jayanthi S J Recept Signal Transduct Res; 2017 Feb; 37(1):51-59. PubMed ID: 27056562 [TBL] [Abstract][Full Text] [Related]
6. Computational prediction for designing novel ketonic derivatives as potential inhibitors for breast cancer: A trade-off between drug likeness and inhibition potency. Muhammad S; Zahir N; Bibi S; Alshahrani MY; Shafiq-urRehman ; Chaudhry AR; Sarwar F; Tousif MI Comput Biol Chem; 2024 Apr; 109():108020. PubMed ID: 38286082 [TBL] [Abstract][Full Text] [Related]
7. Identification of potential inhibitors of HER2 targeting breast cancer-a structure-based drug design approach. Singh G; Al-Fahad D; Al-Zrkani MK; Chaudhuri TK; Soni H; Tandon S; Narasimhaji CV; Azam F; Patil R J Biomol Struct Dyn; 2024 Sep; 42(15):8184-8201. PubMed ID: 37565730 [TBL] [Abstract][Full Text] [Related]
8. A novel identification approach for discovery of 5-HydroxyTriptamine 2A antagonists: combination of 2D/3D similarity screening, molecular docking and molecular dynamics. Kumar R; Jade D; Gupta D J Biomol Struct Dyn; 2019 Mar; 37(4):931-943. PubMed ID: 29468945 [TBL] [Abstract][Full Text] [Related]
9. Targeting protein tyrosine phosphatase to unravel possible inhibitors for Streptococcus pneumoniae using molecular docking, molecular dynamics simulations coupled with free energy calculations. Zaman Z; Khan S; Nouroz F; Farooq U; Urooj A Life Sci; 2021 Jan; 264():118621. PubMed ID: 33164832 [TBL] [Abstract][Full Text] [Related]
10. Discovery of Novel DPP-IV Inhibitors as Potential Candidates for the Treatment of Type 2 Musoev A; Numonov S; You Z; Gao H Molecules; 2019 Aug; 24(16):. PubMed ID: 31394858 [TBL] [Abstract][Full Text] [Related]
11. Discovery of Potential Chemical Probe as Inhibitors of CXCL12 Using Ligand-Based Virtual Screening and Molecular Dynamic Simulation. Haider S; Barakat A; Ul-Haq Z Molecules; 2020 Oct; 25(20):. PubMed ID: 33092204 [TBL] [Abstract][Full Text] [Related]
12. In silico molecular docking and dynamic simulation of eugenol compounds against breast cancer. Rasul HO; Aziz BK; Ghafour DD; Kivrak A J Mol Model; 2021 Dec; 28(1):17. PubMed ID: 34962586 [TBL] [Abstract][Full Text] [Related]
13. Identification of potential PKC inhibitors through pharmacophore designing, 3D-QSAR and molecular dynamics simulations targeting Alzheimer's disease. Iqbal S; Anantha Krishnan D; Gunasekaran K J Biomol Struct Dyn; 2018 Nov; 36(15):4029-4044. PubMed ID: 29182053 [TBL] [Abstract][Full Text] [Related]
14. Identification of anti-filarial leads against aspartate semialdehyde dehydrogenase of Wolbachia endosymbiont of Brugia malayi: combined molecular docking and molecular dynamics approaches. Amala M; Rajamanikandan S; Prabhu D; Surekha K; Jeyakanthan J J Biomol Struct Dyn; 2019 Feb; 37(2):394-410. PubMed ID: 29334340 [TBL] [Abstract][Full Text] [Related]
15. Virtual Screening of Novel Glucosamine-6-Phosphate Synthase Inhibitors. Lather A; Sharma S; Khatkar A Comb Chem High Throughput Screen; 2018; 21(3):182-193. PubMed ID: 29600755 [TBL] [Abstract][Full Text] [Related]
16. In silico assessment of new progesterone receptor inhibitors using molecular dynamics: a new insight into breast cancer treatment. Zarezade V; Abolghasemi M; Rahim F; Veisi A; Behbahani M J Mol Model; 2018 Nov; 24(12):337. PubMed ID: 30415281 [TBL] [Abstract][Full Text] [Related]
18. Structure-based virtual screening of influenza virus RNA polymerase inhibitors from natural compounds: Molecular dynamics simulation and MM-GBSA calculation. Jin Z; Wang Y; Yu XF; Tan QQ; Liang SS; Li T; Zhang H; Shaw PC; Wang J; Hu C Comput Biol Chem; 2020 Apr; 85():107241. PubMed ID: 32120300 [TBL] [Abstract][Full Text] [Related]
19. Exploration of New and Potent Lead Molecules Against CAAX Prenyl Protease I of Leishmania donovani Through Pharmacophore Based Virtual Screening Approach. Prabhu SV; Tiwari K; Suryanarayanan V; Dubey VK; Singh SK Comb Chem High Throughput Screen; 2017; 20(3):255-271. PubMed ID: 28116998 [TBL] [Abstract][Full Text] [Related]