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Application

Discovery Studio 1.0 Materials Studio 0.4004396984924623 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059470264867566215 Amorphous Cell 0.07296351824087956 Blends 4.997501249375312E-4 CASTEP 0.1714142928535732 CDOCKER 0.15992003998001 CHARMm 0.24287856071964017 COMPASS 0.14642678660669664 COMPASS III 0.03298350824587706 COSMObase 4.997501249375312E-4 COSMOconf 0.0 COSMOperm 4.997501249375312E-4 COSMOplex 0.0 COSMOquick 4.997501249375312E-4 COSMOtherm 0.022488755622188907 Catalyst 0.2653673163418291 Classical Simulations 0.5792103948025987 Conformers 0.0 Crystallization 0.06296851574212893 DFTB Plus 0.00399800099950025 DMol3 0.10294852573713144 DPD 4.997501249375312E-4 Discover 9.995002498750624E-4 Forcite 0.22138930534732634 GULP 0.010494752623688156 Kinetix 0.0 LUDI 0.00399800099950025 LibDock 0.05697151424287856 LigandFit 0.0034982508745627187 MCSS 4.997501249375312E-4 MODELER 0.12443778110944528 MesoDyn 9.995002498750624E-4 Mesocite 4.997501249375312E-4 Mesoscale 0.0024987506246876563 Morphology 0.0079960019990005 Polymorph 0.0 QSAR 4.997501249375312E-4 Quantum Mechanics 0.2703648175912044 Reflex 0.053973013493253376 Reflex Plus 0.0 Semi-empirical 0.004497751124437781 Sorption 0.02348825587206397 VAMP 0.0 Visualization 1.0 ZDOCK 0.00849575212393803

Year

2021 0.0 2022 0.34571997345719974 2023 0.6071665560716656 2024 1.0 2025 0.9110816191108162 2026 0.18911745189117452 2027 0.0

Keywords

synthesis 1.0 target 0.9720512820512821 docking 0.4269230769230769 synthesized 0.41025641025641024 visualization 0.3323076923076923 potential 0.2907692307692308 novel 0.25974358974358974 compound 0.18666666666666668 activity 0.16538461538461538 analysis 0.15256410256410258 design 0.14666666666666667 binding 0.09923076923076923 promising 0.09897435897435898 vitro 0.07897435897435898 inhibition 0.06794871794871794 potent 0.06564102564102564 between 0.05358974358974359 silico 0.03641025641025641 active 0.01717948717948718 drug 0.014871794871794871 designed 0.007948717948717949 evaluation 0.006666666666666667 development 0.0020512820512820513 effective 0.001282051282051282 characterization 0.0
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