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Application

Discovery Studio 1.0 Materials Studio 0.1250814332247557 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.011267605633802818 Amorphous Cell 0.03943661971830986 CASTEP 0.09154929577464789 CDOCKER 0.34225352112676055 CHARMm 0.44366197183098594 COMPASS 0.04366197183098591 COMPASS III 0.02676056338028169 COSMObase 0.0014084507042253522 COSMOconf 0.0028169014084507044 COSMOtherm 0.028169014084507043 Catalyst 0.16901408450704225 Classical Simulations 0.5577464788732395 Crystallization 0.011267605633802818 DMol3 0.08169014084507042 Discover 0.0 Forcite 0.07323943661971831 GULP 0.004225352112676056 LUDI 0.0014084507042253522 LibDock 0.12112676056338029 LigandFit 0.007042253521126761 MODELER 0.43802816901408453 Morphology 0.0 QMERA 0.0 Quantum Mechanics 0.1676056338028169 Reflex 0.011267605633802818 Semi-empirical 0.0 Sorption 0.0014084507042253522 Visualization 1.0 ZDOCK 0.04225352112676056

Year

2023 0.0 2024 0.4857667584940312 2025 1.0 2026 0.13774104683195593

Keywords

activity 1.0 target 0.9673469387755103 docking 0.49047619047619045 potential 0.4530612244897959 visualization 0.2673469387755102 analysis 0.26598639455782314 binding 0.17959183673469387 novel 0.16054421768707483 vitro 0.13129251700680272 promising 0.12993197278911564 inhibition 0.10884353741496598 silico 0.08843537414965986 compound 0.08095238095238096 synthesized 0.07142857142857142 protein 0.07006802721088436 synthesis 0.0673469387755102 therapeutic 0.05782312925170068 between 0.050340136054421766 potent 0.03877551020408163 development 0.02585034013605442 treatment 0.02108843537414966 including 0.0163265306122449 drug 0.006122448979591836 effective 6.802721088435374E-4 strong 0.0
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