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Original Articles

Molecular modelling and docking studies on heat shock protein 90 (Hsp90) inhibitors

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Pages 1-20 | Received 06 Jul 2009, Accepted 11 Nov 2009, Published online: 06 Apr 2010

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A.K. Saxena & K.K. Roy. (2012) Hierarchical virtual screening: identification of potential high-affinity and selective β3-adrenergic receptor agonists. SAR and QSAR in Environmental Research 23:5-6, pages 389-407.
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S. Saxena, S.S. Chaudhaery, K. Varshney & A.K. Saxena. (2010) Pharmacophore-based virtual screening and docking studies on Hsp90 inhibitors. SAR and QSAR in Environmental Research 21:5-6, pages 445-462.
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Amal M. Alosaimy, Amr S. Abouzied, Amani M. R. Alsaedi, Ahmed Alafnan, Abdulwahab Alamri, Mubarak A. Alamri, Mohammed Khaled Bin Break, Rehab Sabour & Thoraya A. Farghaly. (2023) Discovery of novel indene-based hybrids as breast cancer inhibitors targeting Hsp90: Synthesis, bio-evaluation and molecular docking study. Arabian Journal of Chemistry 16:4, pages 104569.
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Senzosenkosi S. Mkhize, Kgothatso E. Machaba, Mthokozisi B. C. Simelane & Ofentse J. Pooe. 2022. Drug Development for Malaria. Drug Development for Malaria 235 249 .
Ayanda M. Magwenyane, Monsurat M. Lawal, Daniel G. Amoako, Anou M. Somboro, Clement Agoni, Rene B. Khan, NdumisoN. Mhlongo & Hezekiel M. Kumalo. (2022) Exploring the inhibitory mechanism of resorcinylic isoxazole amine NVP-AUY922 towards the discovery of potential heat shock protein 90 (Hsp90) inhibitors. Scientific African 15, pages e01107.
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Asma Nazar, Ghulam Abbas & Syed Sikander Azam. (2020) Deciphering the Inhibition Mechanism of under Trial Hsp90 Inhibitors and Their Analogues: A Comparative Molecular Dynamics Simulation. Journal of Chemical Information and Modeling 60:8, pages 3812-3830.
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Philip Prathipati, Chioko Nagao, Shandar Ahmad & Kenji Mizuguchi. (2016) Improved pose and affinity predictions using different protocols tailored on the basis of data availability. Journal of Computer-Aided Molecular Design 30:9, pages 817-828.
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Deepak Singla, Meenakshi Anurag, Debasis Dash & Gajendra PS Raghava. (2011) A web server for predicting inhibitors against bacterial target GlmU protein. BMC Pharmacology 11:1.
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