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Application

Discovery Studio 0.4848440041401745 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07715914072775099 Amorphous Cell 0.313020604997808 Blends 0.00263042525208242 CASTEP 0.4548443665059185 CDOCKER 0.10740903112669882 CHARMm 0.1705392371766769 COMPASS 0.40092064883822887 COMPASS III 0.08987286277948268 COSMObase 0.003726435773783428 COSMOconf 0.005041648399824638 COSMOmic 0.0 COSMOperm 0.0015344147303814116 COSMOplex 0.0 COSMOquick 0.0021920210434020165 COSMOtherm 0.07277509864094696 Cantera 0.0 Catalyst 0.04734765453748356 Classical Simulations 1.0 Conformers 8.768084173608067E-4 Crystallization 0.0797895659798334 DFTB Plus 0.007233669443226655 DMol3 0.19947391494958353 DPD 0.003288031565103025 Discover 0.003288031565103025 Forcite 0.6111354669004823 GULP 0.02761946514686541 Kinetix 2.1920210434020167E-4 LUDI 0.0024112231477422183 LibDock 0.04471722928540114 LigandFit 0.0021920210434020165 MODELER 0.16615519508987286 MesoDyn 0.0010960105217010083 Mesocite 0.003288031565103025 Mesoscale 0.007452871547566856 Modules 0.0 Morphology 0.018851380973257344 ONETEP 0.0010960105217010083 Polymorph 0.0015344147303814116 QSAR 0.00131521262604121 Quantum Mechanics 0.6402893467777291 Reflex 0.05786935554581324 Reflex Plus 0.0017536168347216134 Semi-empirical 0.00898728627794827 Sorption 0.060938185006576065 Synthia 0.0015344147303814116 TURBOMOLE 4.3840420868040335E-4 VAMP 0.0015344147303814116 Visualization 0.4723805348531346 X-Cell 0.0017536168347216134 ZDOCK 0.017755370451556333

Year

2025 0.0

Keywords

target 1.0 potential 0.26412413943831275 between 0.177139110479729 analysis 0.17233089279860125 energy 0.13441153972243472 docking 0.10392306851710195 novel 0.08359742104688012 visualization 0.0816304229046006 cell 0.08119331220631625 performance 0.07988198011146323 promising 0.07660364987433067 stability 0.05125122937383893 experimental 0.04950278658070156 including 0.03409463446617856 enhanced 0.02753797399191345 binding 0.026554474920773685 effective 0.023713255381925473 interaction 0.019123593049939897 development 0.017156594907660364 mechanism 0.01639165118566277 synthesized 0.016282373511091686 strong 0.0132225986231013 amorphous 0.008195825592831385 activity 0.006338105125122937 design 0.0
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