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Application

Discovery Studio 1.0 Materials Studio 0.6984126984126984 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04717948717948718 Amorphous Cell 0.2523076923076923 Blends 0.0020512820512820513 CASTEP 0.2082051282051282 CDOCKER 0.20615384615384616 CHARMm 0.32 COMPASS 0.30974358974358973 COMPASS III 0.1117948717948718 COSMObase 0.003076923076923077 COSMOconf 0.008205128205128205 COSMOmic 0.0 COSMOperm 0.0010256410256410256 COSMOtherm 0.06461538461538462 Catalyst 0.08717948717948718 Classical Simulations 1.0 Crystallization 0.07282051282051281 DFTB Plus 0.0020512820512820513 DMol3 0.08512820512820513 DPD 0.0020512820512820513 Discover 0.003076923076923077 Forcite 0.48717948717948717 GULP 0.0071794871794871795 Kinetix 0.0 LUDI 0.0 LibDock 0.08102564102564103 LigandFit 0.0010256410256410256 MODELER 0.28307692307692306 Mesocite 0.003076923076923077 Mesoscale 0.005128205128205128 Morphology 0.014358974358974359 ONETEP 0.0020512820512820513 Polymorph 0.0010256410256410256 Quantum Mechanics 0.29333333333333333 Reflex 0.05333333333333334 Reflex Plus 0.0 Semi-empirical 0.0020512820512820513 Sorption 0.059487179487179485 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.801025641025641 X-Cell 0.0 ZDOCK 0.03076923076923077

Year

2025 1.0 2026 0.7524271844660194 2027 0.0

Keywords

target 1.0 potential 0.32794909446891823 docking 0.28144884973078804 analysis 0.2305433186490455 visualization 0.20313264806656878 binding 0.11551639745472345 between 0.10817425354870289 novel 0.1013215859030837 promising 0.1013215859030837 activity 0.08125305922662751 cell 0.05286343612334802 therapeutic 0.05286343612334802 stability 0.03573176700930005 strong 0.03524229074889868 including 0.033284385707293196 energy 0.021536955457660302 synthesized 0.01908957415565345 mechanism 0.01762114537444934 development 0.01566324033284386 effective 0.01566324033284386 strategy 0.013215859030837005 protein 0.011747430249632892 performance 0.005873715124816446 inhibition 4.894762604013706E-4 synthesis 0.0
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