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Application

Discovery Studio 1.0 Materials Studio 0.1388888888888889 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.00946372239747634 Amorphous Cell 0.0473186119873817 CASTEP 0.07570977917981073 CDOCKER 0.28391167192429023 CHARMm 0.416403785488959 COMPASS 0.04100946372239748 COMPASS III 0.025236593059936908 COSMObase 0.0031545741324921135 COSMOtherm 0.025236593059936908 Catalyst 0.138801261829653 Classical Simulations 0.5394321766561514 Crystallization 0.015772870662460567 DMol3 0.08832807570977919 Forcite 0.07886435331230283 GULP 0.0 LUDI 0.0 LibDock 0.11041009463722397 LigandFit 0.0 MODELER 0.4037854889589905 QMERA 0.0 Quantum Mechanics 0.1608832807570978 Reflex 0.015772870662460567 Semi-empirical 0.0 Visualization 1.0 ZDOCK 0.03785488958990536

Year

2024 0.0 2025 1.0 2026 0.0

Keywords

activity 1.0 target 0.9551282051282052 docking 0.5064102564102564 potential 0.44711538461538464 analysis 0.3092948717948718 visualization 0.28205128205128205 binding 0.20512820512820512 novel 0.1330128205128205 promising 0.1282051282051282 vitro 0.11057692307692307 inhibition 0.10576923076923077 silico 0.09455128205128205 compound 0.08814102564102565 synthesis 0.060897435897435896 synthesized 0.049679487179487176 therapeutic 0.046474358974358976 protein 0.041666666666666664 treatment 0.03685897435897436 between 0.028846153846153848 potent 0.02403846153846154 strong 0.016025641025641024 including 0.014423076923076924 development 0.01282051282051282 effective 0.003205128205128205 drug 0.0
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