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Application

Discovery Studio 0.7718120805369127 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.054679284963196635 Amorphous Cell 0.3207150368033649 Blends 0.0 CASTEP 0.3217665615141956 CDOCKER 0.14931650893796003 CHARMm 0.2502628811777077 COMPASS 0.3627760252365931 COMPASS III 0.10515247108307045 COSMObase 0.005257623554153523 COSMOconf 0.0031545741324921135 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.0031545741324921135 COSMOtherm 0.060988433228180865 Catalyst 0.08937960042060988 Classical Simulations 1.0 Crystallization 0.05362776025236593 DFTB Plus 0.004206098843322818 DMol3 0.17981072555205047 DPD 0.0010515247108307045 Discover 0.002103049421661409 Forcite 0.5488958990536278 GULP 0.024185068349106203 LUDI 0.006309148264984227 LibDock 0.06414300736067298 LigandFit 0.005257623554153523 MCSS 0.0010515247108307045 MODELER 0.22712933753943218 Mesocite 0.004206098843322818 Mesoscale 0.005257623554153523 Modules 0.0 Morphology 0.015772870662460567 ONETEP 0.0 QSAR 0.0 Quantum Mechanics 0.4921135646687697 Reflex 0.03680336487907466 Reflex Plus 0.0 Semi-empirical 0.006309148264984227 Sorption 0.06519453207150368 Synthia 0.0 VAMP 0.0010515247108307045 Visualization 0.5226077812828601 X-Cell 0.0 ZDOCK 0.0473186119873817

Year

2021 0.04780876494023904 2022 0.07470119521912351 2023 0.1942231075697211 2024 0.45717131474103584 2025 1.0 2026 0.4860557768924303 2027 0.0

Keywords

critical 1.0 target 0.9308565531475749 potential 0.2595459236326109 between 0.18524251805985553 analysis 0.18059855521155832 role 0.13209494324045407 docking 0.12022703818369453 novel 0.07791537667698659 energy 0.07636738906088751 visualization 0.07275541795665634 binding 0.06914344685242518 promising 0.06707946336429309 cell 0.06449948400412797 development 0.05985552115583075 performance 0.05521155830753354 stability 0.05417956656346749 including 0.04024767801857585 interaction 0.028379772961816305 experimental 0.017027863777089782 mechanism 0.016511867905056758 strategy 0.01238390092879257 enhanced 0.007739938080495356 design 0.007223942208462332 effective 0.003611971104231166 therapeutic 0.0
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