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Application

Discovery Studio 0.9929411764705882 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06324786324786325 Amorphous Cell 0.27806267806267804 Blends 0.0017094017094017094 CASTEP 0.32364672364672364 CDOCKER 0.16638176638176638 CHARMm 0.2672364672364672 COMPASS 0.33618233618233617 COMPASS III 0.1076923076923077 COSMObase 0.004558404558404558 COSMOconf 0.0062678062678062675 COSMOmic 0.0 COSMOperm 5.698005698005698E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.06723646723646724 Catalyst 0.07635327635327635 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07692307692307693 DFTB Plus 0.0017094017094017094 DMol3 0.14814814814814814 DPD 0.002279202279202279 Discover 0.002849002849002849 Forcite 0.5264957264957265 GULP 0.013105413105413105 LUDI 0.003988603988603989 LibDock 0.06267806267806268 LigandFit 0.002849002849002849 MODELER 0.24843304843304842 Mesocite 0.003418803418803419 Mesoscale 0.0062678062678062675 Morphology 0.018803418803418803 ONETEP 0.0011396011396011395 Polymorph 0.0 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.46780626780626783 Reflex 0.05641025641025641 Reflex Plus 0.0 Semi-empirical 0.003988603988603989 Sorption 0.049002849002849 Synthia 5.698005698005698E-4 TURBOMOLE 0.0 VAMP 0.0011396011396011395 Visualization 0.7037037037037037 X-Cell 5.698005698005698E-4 ZDOCK 0.0245014245014245

Year

2024 0.22630111524163568 2025 1.0 2026 0.9093866171003717 2027 0.0

Keywords

target 1.0 potential 0.30575436587460636 docking 0.22530775837389064 analysis 0.22215860292012596 visualization 0.1700543945032923 between 0.14342971657600917 promising 0.09075293444030919 novel 0.07958774692241626 binding 0.07271686229602062 energy 0.06727741196679073 cell 0.0638419696535929 activity 0.04838247924420269 stability 0.04752361866590323 performance 0.03778986544517607 including 0.02004008016032064 strong 0.017463498425422275 development 0.015173203549957057 enhanced 0.012882908674491841 effective 0.01259662181505869 mechanism 0.010306326939593472 synthesized 0.010306326939593472 strategy 0.002004008016032064 interaction 8.588605782994561E-4 design 2.86286859433152E-4 experimental 0.0
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