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Application

Discovery Studio 1.0 Materials Studio 0.8236235595390525 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05657951135876554 Amorphous Cell 0.2558936990998714 Blends 0.002571795970852979 CASTEP 0.2730390055722246 CDOCKER 0.18645520788684097 CHARMm 0.30732961851693097 COMPASS 0.3219031290184312 COMPASS III 0.10115730818688384 COSMObase 0.0034290612944706386 COSMOconf 0.006858122588941277 COSMOmic 0.0 COSMOperm 8.572653236176596E-4 COSMOplex 4.286326618088298E-4 COSMOquick 0.0 COSMOtherm 0.05915130732961852 Catalyst 0.08658379768538363 Classical Simulations 1.0 Conformers 4.286326618088298E-4 Crystallization 0.07115302186026576 DFTB Plus 0.0012858979854264896 DMol3 0.12730390055722246 DPD 0.0017145306472353193 Discover 0.004714959279897128 Forcite 0.5002143163309044 GULP 0.012001714530647235 Kinetix 0.0 LUDI 0.0042863266180882984 LibDock 0.0788684097728247 LigandFit 0.0038576939562794685 MODELER 0.2803257608229747 MesoDyn 0.0 Mesocite 0.0038576939562794685 Mesoscale 0.005572224603514788 Morphology 0.016716673810544362 ONETEP 8.572653236176596E-4 Polymorph 0.0021431633090441492 QMERA 0.0 QSAR 4.286326618088298E-4 Quantum Mechanics 0.39477068152593225 Reflex 0.05100728675525075 Reflex Plus 0.0 Semi-empirical 0.0021431633090441492 Sorption 0.05272181740248607 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7363909129875696 X-Cell 0.0017145306472353193 ZDOCK 0.03386198028289756

Year

2024 0.1916001388406803 2025 1.0 2026 0.9257202360291565 2027 0.0

Keywords

target 1.0 potential 0.33183279742765276 docking 0.2617363344051447 analysis 0.2312968917470525 visualization 0.1787781350482315 between 0.12968917470525188 novel 0.0992497320471597 binding 0.09732047159699893 promising 0.09560557341907824 activity 0.057020364415862806 cell 0.05337620578778135 energy 0.04180064308681672 stability 0.03815648445873526 strong 0.03022508038585209 including 0.025294748124330118 therapeutic 0.01972132904608789 development 0.01757770632368703 performance 0.01757770632368703 effective 0.015862808145766346 synthesized 0.010503751339764202 enhanced 0.0090032154340836 mechanism 0.006645230439442658 protein 0.006645230439442658 interaction 0.0019292604501607716 strategy 0.0
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