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Application

Discovery Studio 1.0 Materials Studio 0.982174955062912 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05957767722473605 Amorphous Cell 0.27884615384615385 Blends 0.0020739064856711916 CASTEP 0.3404977375565611 CDOCKER 0.1700603318250377 CHARMm 0.26677978883861236 COMPASS 0.3476621417797888 COMPASS III 0.10049019607843138 COSMObase 0.004524886877828055 COSMOconf 0.005279034690799397 COSMOmic 1.885369532428356E-4 COSMOperm 0.0013197586726998493 COSMOplex 1.885369532428356E-4 COSMOquick 9.42684766214178E-4 COSMOtherm 0.06598793363499246 Catalyst 0.09276018099547512 Classical Simulations 1.0 Conformers 3.770739064856712E-4 Crystallization 0.07070135746606335 DFTB Plus 0.004524886877828055 DMol3 0.15592006033182504 DPD 0.0024509803921568627 Discover 0.004147812971342383 Forcite 0.5311085972850679 GULP 0.019230769230769232 Kinetix 1.885369532428356E-4 LUDI 0.003393665158371041 LibDock 0.07088989441930618 LigandFit 0.003959276018099547 MODELER 0.24717194570135748 MesoDyn 7.541478129713424E-4 Mesocite 0.0026395173453996985 Mesoscale 0.005467571644042232 Modules 0.0 Morphology 0.01753393665158371 ONETEP 9.42684766214178E-4 Polymorph 0.0022624434389140274 QMERA 1.885369532428356E-4 QSAR 7.541478129713424E-4 Quantum Mechanics 0.48717948717948717 Reflex 0.049962292609351436 Reflex Plus 0.0013197586726998493 Semi-empirical 0.0058446455505279035 Sorption 0.057126696832579184 Synthia 0.0015082956259426848 TURBOMOLE 1.885369532428356E-4 VAMP 7.541478129713424E-4 Visualization 0.7513197586726998 X-Cell 0.0013197586726998493 ZDOCK 0.02828054298642534

Year

2023 0.07653738386668633 2024 0.4288453030526471 2025 1.0 2026 0.60064887184781 2027 0.0

Keywords

target 1.0 potential 0.29998230714791224 docking 0.22452229299363058 analysis 0.21196036801132342 visualization 0.17940552016985137 between 0.1475583864118896 novel 0.09819532908704884 promising 0.08059094125973107 energy 0.0763446567586695 binding 0.07501769285208776 cell 0.06210191082802548 activity 0.05334394904458599 stability 0.03910120311394197 performance 0.03503184713375796 synthesized 0.02167374380750177 including 0.019639065817409766 effective 0.01786978060863411 development 0.01751592356687898 experimental 0.016100495399858458 interaction 0.015038924274593064 mechanism 0.013800424628450107 enhanced 0.00583864118895966 protein 0.004953998584571833 strong 0.0023885350318471337 synthesis 0.0
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