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Application

Discovery Studio 1.0 Materials Studio 0.6961492178098676 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.051094890510948905 Amorphous Cell 0.19290928050052136 Blends 0.0010427528675703858 CASTEP 0.456725755995829 CDOCKER 0.23149113660062565 CHARMm 0.4233576642335766 COMPASS 0.23357664233576642 COMPASS III 0.07716371220020855 COSMObase 0.010427528675703858 COSMOconf 0.0031282586027111575 COSMOquick 0.0010427528675703858 COSMOtherm 0.08342022940563086 Catalyst 0.1762252346193952 Classical Simulations 1.0 Crystallization 0.07820646506777894 DFTB Plus 0.0031282586027111575 DMol3 0.20229405630865485 DPD 0.0010427528675703858 Discover 0.0020855057351407717 Forcite 0.4035453597497393 GULP 0.014598540145985401 Kinetix 0.0 LUDI 0.004171011470281543 LibDock 0.09071949947862357 LigandFit 0.008342022940563087 MODELER 0.3315954118873827 Mesocite 0.0 Mesoscale 0.0020855057351407717 Morphology 0.008342022940563087 ONETEP 0.0 Polymorph 0.0010427528675703858 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.6402502606882169 Reflex 0.0667361835245047 Reflex Plus 0.0010427528675703858 Semi-empirical 0.004171011470281543 Sorption 0.04692387904066736 Visualization 0.9249217935349322 X-Cell 0.0020855057351407717 ZDOCK 0.035453597497393116

Year

2023 0.0012070006035003018 2024 0.43452021726010864 2025 1.0 2026 0.4152082076041038 2027 0.0

Keywords

promising 1.0 target 0.9313609467455621 potential 0.4335305719921105 docking 0.2706114398422091 analysis 0.21577909270216963 novel 0.1629191321499014 visualization 0.14240631163708087 binding 0.10059171597633136 stability 0.07140039447731755 activity 0.07061143984220908 therapeutic 0.06942800788954635 between 0.0611439842209073 development 0.04773175542406312 synthesized 0.04378698224852071 energy 0.04063116370808678 strong 0.035897435897435895 including 0.03431952662721893 strategy 0.029980276134122286 compound 0.029191321499013805 synthesis 0.02445759368836292 effective 0.011834319526627219 vitro 0.009072978303747535 inhibition 0.0067061143984220905 silico 0.001183431952662722 drug 0.0
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