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Application

Discovery Studio 1.0 Materials Studio 0.5384615384615384 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05009823182711198 Amorphous Cell 0.18860510805500982 Blends 0.0 CASTEP 0.2868369351669941 CDOCKER 0.35363457760314343 CHARMm 0.4302554027504912 COMPASS 0.2868369351669941 COMPASS III 0.07465618860510806 COSMObase 0.0 COSMOperm 0.0 COSMOquick 0.0019646365422396855 COSMOtherm 0.03732809430255403 Catalyst 0.2082514734774067 Classical Simulations 1.0 Crystallization 0.0481335952848723 DMol3 0.12868369351669942 DPD 9.823182711198428E-4 Discover 0.0 Forcite 0.41159135559921417 GULP 0.0068762278978389 LUDI 0.009823182711198428 LibDock 0.12475442043222004 LigandFit 0.008840864440078585 MCSS 9.823182711198428E-4 MODELER 0.3880157170923379 MesoDyn 0.0 Mesocite 0.0 Mesoscale 0.0029469548133595285 Morphology 0.0068762278978389 ONETEP 0.0 Polymorph 0.003929273084479371 QSAR 0.0 Quantum Mechanics 0.4106090373280943 Reflex 0.03536345776031434 Reflex Plus 0.0 Sorption 0.022593320235756387 Visualization 0.8506876227897839 X-Cell 0.0 ZDOCK 0.03831041257367387

Year

2023 0.001224739742804654 2024 0.5284751990202082 2025 1.0 2026 0.3453766074709124 2027 0.0

Keywords

novel 1.0 target 0.9428909019298937 potential 0.3749507680189051 docking 0.30917684127609296 analysis 0.18668767231193384 promising 0.14808979913351714 visualization 0.13745569121701456 synthesized 0.12367073651043718 development 0.09846396218983852 binding 0.09570697124852304 activity 0.08704214257581724 synthesis 0.08546671918077983 between 0.07522646711303663 compound 0.06498621504529342 therapeutic 0.03820401732965734 effective 0.02205592753052383 stability 0.016148089799133517 design 0.01339109885781804 protein 0.01260338716029933 including 0.008270972823946435 vitro 0.006301693580149665 inhibition 0.005120126033871603 cell 0.004332414336352895 drug 0.0023631350925561244 potent 0.0
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