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Application

Discovery Studio 1.0 Materials Studio 0.9236036807190242 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05611549986379733 Amorphous Cell 0.2696812857532008 Blends 0.002179242713157178 CASTEP 0.30373195314628165 CDOCKER 0.18033233451375646 CHARMm 0.28575320076273497 COMPASS 0.3282484336692999 COMPASS III 0.11005175701443748 COSMObase 0.004358485426314356 COSMOconf 0.005448106782892944 COSMOmic 0.0 COSMOperm 2.7240533914464724E-4 COSMOplex 2.7240533914464724E-4 COSMOquick 5.448106782892945E-4 COSMOtherm 0.06292563334241351 Catalyst 0.08035957504767094 Classical Simulations 1.0 Conformers 5.448106782892945E-4 Crystallization 0.07218741487333152 DFTB Plus 0.003813674748025061 DMol3 0.14110596567692726 DPD 0.002724053391446472 Discover 0.003541269408880414 Forcite 0.5107600108962136 GULP 0.016889131026968127 Kinetix 2.7240533914464724E-4 LUDI 0.004086080087169709 LibDock 0.0743666575864887 LigandFit 0.004358485426314356 MODELER 0.26559520566603106 MesoDyn 0.0 Mesocite 0.003268864069735767 Mesoscale 0.005720512122037592 Modules 0.0 Morphology 0.01661672568782348 ONETEP 0.001089621356578589 Polymorph 0.002179242713157178 QMERA 2.7240533914464724E-4 QSAR 0.0 Quantum Mechanics 0.4374829746663035 Reflex 0.052029419776627624 Reflex Plus 8.172160174339417E-4 Semi-empirical 0.005175701443748297 Sorption 0.058567147916099155 Synthia 0.001362026695723236 TURBOMOLE 0.0 VAMP 5.448106782892945E-4 Visualization 0.7210569327158812 X-Cell 0.001362026695723236 ZDOCK 0.0294197766276219

Year

2024 0.2994891443167305 2025 1.0 2026 0.7618135376756067 2027 0.0

Keywords

target 1.0 potential 0.31769722814498935 docking 0.23480810234541577 analysis 0.22294776119402984 visualization 0.17004264392324095 between 0.13832622601279318 novel 0.08955223880597014 promising 0.08848614072494669 binding 0.07609275053304904 energy 0.06303304904051173 cell 0.05570362473347548 activity 0.0511727078891258 stability 0.037979744136460554 performance 0.030383795309168442 including 0.022254797441364604 development 0.015325159914712153 synthesized 0.014392324093816631 effective 0.013592750533049041 strong 0.012659914712153518 mechanism 0.010660980810234541 enhanced 0.007462686567164179 interaction 0.0061300639658848615 experimental 0.003464818763326226 protein 0.002398720682302772 strategy 0.0
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