A novel approach for enhancing the potency of kinase inhibitors using topological water networks
Abstract Optimizing the potency of kinase inhibitors remains a major challenge due to the structural conservation of kinase binding pockets. While several computational methods have been developed to address this issue, most overlook the crucial role of water molecules within the binding site. Our r...
में बचाया:
| मुख्य लेखकों: | , , , , |
|---|---|
| स्वरूप: | Artigo |
| भाषा: | Inglês |
| प्रकाशित: |
BMC
2026-03-01
|
| श्रृंखला: | Journal of Cheminformatics |
| विषय: | |
| ऑनलाइन पहुंच: | https://doi.org/10.1186/s13321-026-01188-4 |
| टैग: |
कोई टैग नहीं, इस रिकॉर्ड को टैग करने वाले पहले व्यक्ति बनें!
|