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Application

Discovery Studio 1.0 Materials Studio 0.5096774193548387 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.047619047619047616 Amorphous Cell 0.10714285714285714 CASTEP 0.32142857142857145 CDOCKER 0.2857142857142857 CHARMm 0.39285714285714285 COMPASS 0.17857142857142858 COMPASS III 0.07142857142857142 COSMObase 0.0 COSMOconf 0.0 COSMOtherm 0.07142857142857142 Catalyst 0.08333333333333333 Classical Simulations 0.8928571428571429 Crystallization 0.10714285714285714 DFTB Plus 0.0 DMol3 0.09523809523809523 Forcite 0.2976190476190476 GULP 0.023809523809523808 LUDI 0.011904761904761904 LibDock 0.09523809523809523 MODELER 0.40476190476190477 Polymorph 0.0 Quantum Mechanics 0.4166666666666667 Reflex 0.09523809523809523 Semi-empirical 0.0 Sorption 0.03571428571428571 Visualization 1.0 ZDOCK 0.05952380952380952

Year

2025 1.0 2026 0.0

Keywords

well 1.0 target 0.910377358490566 potential 0.4009433962264151 docking 0.330188679245283 analysis 0.19811320754716982 visualization 0.19339622641509435 binding 0.13679245283018868 activity 0.09905660377358491 promising 0.09433962264150944 between 0.08018867924528301 novel 0.08018867924528301 including 0.0660377358490566 inhibition 0.06132075471698113 therapeutic 0.06132075471698113 mechanism 0.04716981132075472 development 0.03773584905660377 energy 0.02358490566037736 stability 0.02358490566037736 treatment 0.02358490566037736 compound 0.018867924528301886 effective 0.018867924528301886 protein 0.018867924528301886 silico 0.009433962264150943 vitro 0.009433962264150943 induced 0.0
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