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Application

Discovery Studio 1.0 Materials Studio 0.825474717303179 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05669800235017626 Amorphous Cell 0.2599882491186839 Blends 0.002056404230317274 CASTEP 0.29524089306698004 CDOCKER 0.19477085781433606 CHARMm 0.3099294947121034 COMPASS 0.3219741480611046 COMPASS III 0.10311398354876616 COSMObase 0.00499412455934195 COSMOconf 0.005287896592244419 COSMOmic 0.0 COSMOperm 5.875440658049354E-4 COSMOplex 2.937720329024677E-4 COSMOquick 8.813160987074031E-4 COSMOtherm 0.060517038777908344 Catalyst 0.0846063454759107 Classical Simulations 1.0 Conformers 2.937720329024677E-4 Crystallization 0.0699177438307873 DFTB Plus 0.0035252643948296123 DMol3 0.13836662749706227 DPD 0.0026439482961222094 Discover 0.004112808460634548 Forcite 0.49324324324324326 GULP 0.015569917743830788 Kinetix 0.0 LUDI 0.004406580493537015 LibDock 0.07873090481786134 LigandFit 0.004112808460634548 MODELER 0.28554641598119856 Mesocite 0.0035252643948296123 Mesoscale 0.005581668625146886 Morphology 0.01527614571092832 ONETEP 8.813160987074031E-4 Polymorph 0.0026439482961222094 QMERA 2.937720329024677E-4 QSAR 2.937720329024677E-4 Quantum Mechanics 0.427144535840188 Reflex 0.05082256169212691 Reflex Plus 5.875440658049354E-4 Semi-empirical 0.004700352526439483 Sorption 0.05434782608695652 Synthia 8.813160987074031E-4 TURBOMOLE 0.0 VAMP 2.937720329024677E-4 Visualization 0.7685076380728555 X-Cell 0.0011750881316098707 ZDOCK 0.03260869565217391

Year

2024 0.32770022042615726 2025 1.0 2026 0.9186872397746755 2027 0.0

Keywords

target 1.0 potential 0.33821628608358467 docking 0.26640815740341806 analysis 0.24041361482119775 visualization 0.19014792474508113 between 0.13614821197759586 novel 0.1003877638948729 promising 0.09923883383599023 binding 0.09636650868878358 activity 0.06261668820910526 cell 0.05529225908372828 energy 0.05529225908372828 stability 0.04222317966393796 including 0.02786155392790464 strong 0.02297860117765331 performance 0.020249892287806978 effective 0.01852649719948298 development 0.018382880942122648 synthesized 0.018382880942122648 protein 0.01263823064770932 therapeutic 0.008616975441619991 mechanism 0.007468045382737326 interaction 0.007037196610656327 enhanced 0.00674996409593566 synthesis 0.0
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