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Application

Discovery Studio 1.0 Materials Studio 0.4691358024691358 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04678362573099415 Amorphous Cell 0.1871345029239766 CASTEP 0.2573099415204678 CDOCKER 0.23976608187134502 CHARMm 0.38596491228070173 COMPASS 0.30409356725146197 COMPASS III 0.07602339181286549 COSMOconf 0.005847953216374269 COSMOtherm 0.06432748538011696 Catalyst 0.14619883040935672 Classical Simulations 0.9649122807017544 Crystallization 0.04093567251461988 DFTB Plus 0.0 DMol3 0.08187134502923976 Discover 0.0 Forcite 0.3742690058479532 GULP 0.0 Kinetix 0.0 LibDock 0.07017543859649122 MODELER 0.3742690058479532 Mesocite 0.0 Mesoscale 0.0 Morphology 0.0 Quantum Mechanics 0.3333333333333333 Reflex 0.03508771929824561 Semi-empirical 0.0 Sorption 0.05263157894736842 Visualization 1.0 ZDOCK 0.04678362573099415

Year

2025 1.0 2026 0.5149700598802395 2027 0.0

Keywords

potential 1.0 target 0.9363207547169812 docking 0.37735849056603776 analysis 0.3113207547169811 visualization 0.2028301886792453 binding 0.16745283018867924 therapeutic 0.16037735849056603 promising 0.15566037735849056 activity 0.14858490566037735 novel 0.14386792452830188 strong 0.10377358490566038 stability 0.07075471698113207 including 0.0660377358490566 between 0.06367924528301887 inhibition 0.0589622641509434 vitro 0.05660377358490566 development 0.04245283018867924 synthesized 0.03773584905660377 silico 0.025943396226415096 cell 0.018867924528301886 protein 0.018867924528301886 treatment 0.01179245283018868 effective 0.0023584905660377358 synthesis 0.0023584905660377358 compound 0.0
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