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Application

Discovery Studio 0.9758707919828761 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05682903533906399 Amorphous Cell 0.28247373447946517 Blends 0.002387774594078319 CASTEP 0.3256924546322827 CDOCKER 0.16786055396370583 CHARMm 0.2614613180515759 COMPASS 0.3438395415472779 COMPASS III 0.10840496657115568 COSMObase 0.004297994269340974 COSMOconf 0.0052531041069723014 COSMOmic 0.0 COSMOperm 2.387774594078319E-4 COSMOplex 2.387774594078319E-4 COSMOquick 9.551098376313276E-4 COSMOtherm 0.06423113658070678 Catalyst 0.08237822349570201 Classical Simulations 1.0 Conformers 4.775549188156638E-4 Crystallization 0.0725883476599809 DFTB Plus 0.004775549188156638 DMol3 0.15066857688634194 DPD 0.002387774594078319 Discover 0.0031041069723018147 Forcite 0.5315186246418339 GULP 0.01862464183381089 Kinetix 2.387774594078319E-4 LUDI 0.002387774594078319 LibDock 0.06709646609360076 LigandFit 0.004059216809933142 MODELER 0.24498567335243554 MesoDyn 0.0 Mesocite 0.0031041069723018147 Mesoscale 0.0052531041069723014 Modules 0.0 Morphology 0.016714422158548233 ONETEP 0.0011938872970391596 Polymorph 0.0026265520534861507 QMERA 2.387774594078319E-4 QSAR 2.387774594078319E-4 Quantum Mechanics 0.4682425978987584 Reflex 0.05205348615090735 Reflex Plus 9.551098376313276E-4 Semi-empirical 0.0062082139446036294 Sorption 0.060649474689589304 Synthia 0.0011938872970391596 TURBOMOLE 2.387774594078319E-4 VAMP 7.163323782234957E-4 Visualization 0.7029608404966571 X-Cell 0.0011938872970391596 ZDOCK 0.027220630372492838

Year

2023 1.8712574850299402E-4 2024 0.3849176646706587 2025 1.0 2026 0.6644835329341318 2027 0.0

Keywords

target 1.0 potential 0.30446862699699007 docking 0.2179902755267423 analysis 0.2167168326001389 visualization 0.1689048390831211 between 0.14783514702477427 novel 0.09608705718916416 promising 0.08624681639268349 energy 0.08277379022921973 binding 0.07061819865709655 cell 0.06575596202824728 activity 0.051632322296827966 performance 0.04549664274137532 stability 0.04063440611252605 including 0.025121555915721232 synthesized 0.023037740217642974 development 0.020143551748089836 mechanism 0.019680481592961332 experimental 0.01875434128270433 effective 0.017365130817318823 enhanced 0.014239407270201435 interaction 0.01157675387821255 strong 0.00949293818013429 protein 0.0015049780041676314 strategy 0.0
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