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Application

Discovery Studio 1.0 Materials Studio 0.6411682892906815 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0446985446985447 Amorphous Cell 0.24116424116424118 Blends 0.0010395010395010396 CASTEP 0.18191268191268192 CDOCKER 0.20893970893970895 CHARMm 0.32536382536382535 COMPASS 0.2972972972972973 COMPASS III 0.1101871101871102 COSMObase 0.002079002079002079 COSMOconf 0.009355509355509356 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.06444906444906445 Catalyst 0.10810810810810811 Classical Simulations 1.0 Crystallization 0.06756756756756757 DFTB Plus 0.0010395010395010396 DMol3 0.0841995841995842 DPD 0.002079002079002079 Discover 0.004158004158004158 Forcite 0.4812889812889813 GULP 0.007276507276507277 Kinetix 0.0 LUDI 0.002079002079002079 LibDock 0.08523908523908524 LigandFit 0.004158004158004158 MODELER 0.3024948024948025 Mesocite 0.002079002079002079 Mesoscale 0.004158004158004158 Morphology 0.014553014553014554 ONETEP 0.002079002079002079 Polymorph 0.0 Quantum Mechanics 0.2661122661122661 Reflex 0.04885654885654886 Semi-empirical 0.0010395010395010396 Sorption 0.056133056133056136 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.8326403326403327 ZDOCK 0.035343035343035345

Year

2025 1.0 2026 0.6936997319034852 2027 0.0

Keywords

target 1.0 potential 0.34499514091350825 docking 0.29008746355685133 analysis 0.24295432458697766 visualization 0.2099125364431487 binding 0.11273080660835763 novel 0.10884353741496598 between 0.10447035957240039 promising 0.10447035957240039 activity 0.0782312925170068 therapeutic 0.061710398445092324 cell 0.0456754130223518 strong 0.03595724003887269 including 0.03547133138969873 stability 0.029154518950437316 synthesized 0.026239067055393587 development 0.0228377065111759 mechanism 0.018950437317784258 energy 0.017006802721088437 protein 0.017006802721088437 strategy 0.010689990281827016 synthesis 0.01020408163265306 effective 0.006316812439261419 silico 0.0029154518950437317 inhibition 0.0
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