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Application

Discovery Studio 0.8696666666666667 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0640373197625106 Amorphous Cell 0.29219677692960133 Blends 0.0016963528413910093 CASTEP 0.35368956743002544 CDOCKER 0.15267175572519084 CHARMm 0.24130619168787107 COMPASS 0.3379983036471586 COMPASS III 0.11450381679389313 COSMObase 0.004664970313825276 COSMOconf 0.006785411365564037 COSMOmic 0.0 COSMOperm 4.2408821034775233E-4 COSMOplex 0.0 COSMOquick 4.2408821034775233E-4 COSMOtherm 0.0720949957591179 Catalyst 0.0729431721798134 Classical Simulations 1.0 Conformers 4.2408821034775233E-4 Crystallization 0.07548770144189991 DFTB Plus 0.001272264631043257 DMol3 0.15521628498727735 DPD 0.0021204410517387615 Discover 0.002544529262086514 Forcite 0.549618320610687 GULP 0.016115351993214587 Kinetix 0.0 LUDI 0.004240882103477523 LibDock 0.061068702290076333 LigandFit 0.003816793893129771 MCSS 0.0 MODELER 0.22561492790500423 MesoDyn 0.0 Mesocite 0.0033927056827820186 Mesoscale 0.006361323155216285 Morphology 0.017811704834605598 ONETEP 0.001272264631043257 Polymorph 0.0 QMERA 0.0 QSAR 4.2408821034775233E-4 Quantum Mechanics 0.5021204410517388 Reflex 0.05555555555555555 Reflex Plus 0.0 Semi-empirical 0.003816793893129771 Sorption 0.0551314673452078 Synthia 0.001272264631043257 TURBOMOLE 0.0 VAMP 0.0016963528413910093 Visualization 0.6641221374045801 X-Cell 0.001272264631043257 ZDOCK 0.022900763358778626

Year

2024 0.33643307871139155 2025 1.0 2026 0.7000996346728662 2027 0.0

Keywords

target 1.0 potential 0.28568456096545986 analysis 0.20183104452767375 docking 0.19246774864752392 visualization 0.1489804411152726 between 0.143986683312526 energy 0.07740324594257178 promising 0.07740324594257178 novel 0.07657095297544736 cell 0.06367041198501873 binding 0.052850603412401165 performance 0.050977944236371205 stability 0.04161464835622139 activity 0.03433208489388265 enhanced 0.0178942987931752 experimental 0.015397419891801914 including 0.015189346650020807 synthesized 0.013524760715771952 mechanism 0.012484394506866416 effective 0.01019558884727424 development 0.008531002913025386 strong 0.00478568456096546 design 0.002913025384935497 strategy 0.0010403662089055348 interaction 0.0
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