Tool to predict water molecules placement and energy in ligand binding sites
☆37Sep 16, 2025Updated 8 months ago
Alternatives and similar repositories for waterkit
Users that are interested in waterkit are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Genetic algorithm to convert 3D-RISM solvent densities to explicit water molecules in binding pockets☆13Dec 19, 2017Updated 8 years ago
- WaterDock-2.0 implementation with Akshay Sridhar☆21Nov 2, 2023Updated 2 years ago
- Efficient Sampling of PROTAC-Induced Ternary Complexes☆16Jun 3, 2025Updated last year
- CosolvKit is a versatile tool for cosolvent MD preparation and analysis☆31Updated this week