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Application

Discovery Studio 1.0 Materials Studio 0.43395522388059704 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060393258426966294 Amorphous Cell 0.15519662921348315 Blends 7.022471910112359E-4 CASTEP 0.3223314606741573 CDOCKER 0.2169943820224719 CHARMm 0.3862359550561798 COMPASS 0.18047752808988765 COMPASS III 0.05266853932584269 COSMObase 0.004213483146067416 COSMOconf 0.004213483146067416 COSMOmic 0.0 COSMOperm 7.022471910112359E-4 COSMOtherm 0.05688202247191011 Catalyst 0.10252808988764045 Classical Simulations 0.7949438202247191 Conformers 0.0 Crystallization 0.03089887640449438 DFTB Plus 0.002106741573033708 DMol3 0.11587078651685394 DPD 0.0 Discover 0.0014044943820224719 Forcite 0.2752808988764045 GULP 0.016853932584269662 LUDI 0.007022471910112359 LibDock 0.09691011235955056 LigandFit 0.0014044943820224719 MODELER 0.398876404494382 Mesocite 0.0028089887640449437 Mesoscale 0.0035112359550561797 Modules 0.0 Morphology 0.007724719101123595 Polymorph 0.0014044943820224719 QMERA 0.0 QSAR 7.022471910112359E-4 Quantum Mechanics 0.42907303370786515 Reflex 0.018960674157303372 Reflex Plus 0.0 Semi-empirical 0.0028089887640449437 Sorption 0.030196629213483147 Visualization 1.0 X-Cell 0.002106741573033708 ZDOCK 0.03581460674157303

Year

2024 0.5660009741841208 2025 1.0 2026 0.4271797369702874 2027 0.0

Keywords

analysis 1.0 target 0.9211606096131302 potential 0.43522860492379833 docking 0.42057444314185227 visualization 0.2224501758499414 binding 0.16735052754982416 between 0.13452520515826494 promising 0.09320046893317702 novel 0.08352872215709262 activity 0.0738569753810082 stability 0.06887456037514654 protein 0.0627198124267292 including 0.058323563892145366 therapeutic 0.055392731535756155 silico 0.04249706916764361 interaction 0.03751465416178194 strong 0.03604923798358734 energy 0.01817116060961313 vitro 0.011723329425556858 treatment 0.010257913247362251 mechanism 0.00615474794841735 development 0.004689331770222743 effective 0.0017584994138335288 inhibition 0.0011723329425556857 compound 0.0
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