91,71 €
107,89 €
-15% su kodu: ENG15
Multitarget inhibitors for TryS, TryR and TryP in Leishmania donovani
91,71 € 
- Išsiųsime per 10–14 d.d.
The present study focuses on multi target inhibitors search based on proteins of Trypanothione pathway. For this we had modelled TryS, TryR and TryP proteins using Homology modelling and validated, based on which docking calculations were done. In the next step, active sites were explored to allow compounds to dock. Finally, we screened common hits amongst these protein targets. Top compounds were validated and their ADME profiles were also predicted. Some ligands shown good Glide Gscore in all…
91.71
2025-08-10 23:59:00
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- Autorius: Vikas Gautam
- Leidėjas: LAP Lambert Academic Publishing
- ISBN-10: 3659212849
- ISBN-13: 9783659212840
- Formatas: 15.2 x 22.9 x 0.7 cm, minkšti viršeliai
- Kalba: Anglų
- Extra -15 % nuolaida šiai knygai su kodu: ENG15
Multitarget inhibitors for TryS, TryR and TryP in Leishmania donovani + nemokamas atvežimas! | knygos.lt
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The present study focuses on multi target inhibitors search based on proteins of Trypanothione pathway. For this we had modelled TryS, TryR and TryP proteins using Homology modelling and validated, based on which docking calculations were done. In the next step, active sites were explored to allow compounds to dock. Finally, we screened common hits amongst these protein targets. Top compounds were validated and their ADME profiles were also predicted. Some ligands shown good Glide Gscore in all three protein Targets. Interaction profiles can be further utilized to build computational novel structures. The further work needed to fit the hits molecules in assays to validate hits and refine or optimize the hit molecules.EXTRA 15 % nuolaida su kodu: ENG15
91,71 €
107,89 €
Išsiųsime per 10–14 d.d.
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- Autorius: Vikas Gautam
- Leidėjas: LAP Lambert Academic Publishing
- ISBN-10: 3659212849
- ISBN-13: 9783659212840
- Formatas: 15.2 x 22.9 x 0.7 cm, minkšti viršeliai
- Kalba: Anglų
The present study focuses on multi target inhibitors search based on proteins of Trypanothione pathway. For this we had modelled TryS, TryR and TryP proteins using Homology modelling and validated, based on which docking calculations were done. In the next step, active sites were explored to allow compounds to dock. Finally, we screened common hits amongst these protein targets. Top compounds were validated and their ADME profiles were also predicted. Some ligands shown good Glide Gscore in all three protein Targets. Interaction profiles can be further utilized to build computational novel structures. The further work needed to fit the hits molecules in assays to validate hits and refine or optimize the hit molecules.
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