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Application

Discovery Studio 1.0 Materials Studio 0.5213650702609693 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0595677385345282 Amorphous Cell 0.22614654717975752 Blends 0.0010542962572482868 CASTEP 0.25566684238270954 CDOCKER 0.2561939905113337 CHARMm 0.408012651555087 COMPASS 0.2746441750131787 COMPASS III 0.0764364786505008 COSMObase 0.0031628887717448603 COSMOconf 0.005271481286241434 COSMOquick 0.0021085925144965737 COSMOtherm 0.05482340537691091 Catalyst 0.11333684765419083 Classical Simulations 1.0 Crystallization 0.0558777016341592 DFTB Plus 0.004217185028993147 DMol3 0.11597258829731154 DPD 0.0031628887717448603 Discover 0.002635740643120717 Forcite 0.430152872957301 GULP 0.02161307327358988 LUDI 0.005271481286241434 LibDock 0.10542962572482868 LigandFit 0.005271481286241434 MODELER 0.39694254085397995 MesoDyn 0.0015814443858724301 Mesocite 0.0010542962572482868 Mesoscale 0.0063257775434897206 Morphology 0.013178703215603585 Polymorph 5.271481286241434E-4 QSAR 0.0010542962572482868 Quantum Mechanics 0.36425935687928307 Reflex 0.04059040590405904 Reflex Plus 5.271481286241434E-4 Semi-empirical 0.005271481286241434 Sorption 0.03690036900369004 Synthia 5.271481286241434E-4 TURBOMOLE 0.0 VAMP 5.271481286241434E-4 Visualization 0.9541381128096995 X-Cell 0.0015814443858724301 ZDOCK 0.042698998418555616

Year

2025 0.0

Keywords

target 1.0 potential 0.37232181897682554 docking 0.3191954525579362 analysis 0.24289462177525142 visualization 0.20922606034105815 binding 0.12592916484477482 between 0.1239615216440752 novel 0.10668998688237866 promising 0.09619588981198077 activity 0.0815478793178837 including 0.045693047660690864 therapeutic 0.038915609969392216 protein 0.03235679930039353 cell 0.028858766943594228 stability 0.025142107564494972 development 0.019020550940096196 strong 0.018146042850896372 interaction 0.01464801049409707 silico 0.014429383471797114 energy 0.00874508089199825 vitro 0.008307826847398338 inhibition 0.006996064713598601 synthesis 0.004809794490599038 synthesized 0.004591167468299082 effective 0.0
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