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Application

Discovery Studio 1.0 Materials Studio 0.7991004497751124 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05344295991778006 Amorphous Cell 0.26515930113052416 Blends 0.0010277492291880781 CASTEP 0.26002055498458376 CDOCKER 0.19938335046248715 CHARMm 0.31346351490236385 COMPASS 0.32168550873586843 COMPASS III 0.1171634121274409 COSMObase 0.0020554984583761563 COSMOconf 0.0041109969167523125 COSMOperm 0.0 COSMOtherm 0.048304213771839674 Catalyst 0.07913669064748201 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06680369989722508 DFTB Plus 0.0 DMol3 0.10996916752312436 DPD 0.003083247687564234 Discover 0.006166495375128468 Forcite 0.49640287769784175 GULP 0.0051387461459403904 LUDI 0.0010277492291880781 LibDock 0.0750256937307297 LigandFit 0.0041109969167523125 MODELER 0.2641315519013361 Mesocite 0.0041109969167523125 Mesoscale 0.006166495375128468 Morphology 0.013360739979445015 ONETEP 0.0 Polymorph 0.0010277492291880781 Quantum Mechanics 0.3669064748201439 Reflex 0.050359712230215826 Reflex Plus 0.0 Semi-empirical 0.0010277492291880781 Sorption 0.052415210688591986 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7656731757451182 X-Cell 0.0 ZDOCK 0.03494347379239465

Year

2025 1.0 2026 0.8472121650977552 2027 0.0

Keywords

target 1.0 potential 0.3260538344337227 docking 0.26612493651599795 analysis 0.23057389537836465 visualization 0.19451498222447944 between 0.11884205180294566 binding 0.1005586592178771 promising 0.09700355510411376 novel 0.08735398679532758 activity 0.07668867445403758 cell 0.052310817673946165 strong 0.04926358557643474 energy 0.04824784154393093 stability 0.03809040121889284 including 0.030980192991366177 performance 0.025393600812595226 therapeutic 0.0228542407313357 development 0.018791264601320468 mechanism 0.01675977653631285 enhanced 0.0111731843575419 effective 0.009649568308786187 synthesized 0.009141696292534281 protein 0.006602336211274758 interaction 0.005078720162519045 experimental 0.0
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