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Application

Discovery Studio 0.7915040528369859 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0701219512195122 Amorphous Cell 0.2959349593495935 Blends 0.0022357723577235773 CASTEP 0.3955284552845528 CDOCKER 0.13821138211382114 CHARMm 0.2184959349593496 COMPASS 0.37052845528455286 COMPASS III 0.09390243902439024 COSMObase 0.003658536585365854 COSMOconf 0.0065040650406504065 COSMOmic 0.0 COSMOperm 0.0012195121951219512 COSMOplex 4.065040650406504E-4 COSMOquick 8.130081300813008E-4 COSMOtherm 0.07296747967479675 Cantera 0.0 Catalyst 0.09308943089430895 Classical Simulations 1.0 Conformers 6.097560975609756E-4 Crystallization 0.07865853658536585 DFTB Plus 0.0065040650406504065 DMol3 0.1717479674796748 DPD 0.0026422764227642275 Discover 0.0032520325203252032 Forcite 0.5672764227642276 GULP 0.018902439024390243 Kinetix 4.065040650406504E-4 LUDI 0.0032520325203252032 LibDock 0.056707317073170734 LigandFit 0.0032520325203252032 MCSS 6.097560975609756E-4 MODELER 0.19044715447154473 MesoDyn 4.065040650406504E-4 Mesocite 0.0032520325203252032 Mesoscale 0.006097560975609756 Morphology 0.019105691056910568 ONETEP 0.0016260162601626016 Polymorph 0.0016260162601626016 QMERA 0.0 QSAR 0.0010162601626016261 Quantum Mechanics 0.558739837398374 Reflex 0.05630081300813008 Reflex Plus 6.097560975609756E-4 Semi-empirical 0.008130081300813009 Sorption 0.059959349593495935 Synthia 0.0014227642276422765 TURBOMOLE 8.130081300813008E-4 VAMP 0.0012195121951219512 Visualization 0.6926829268292682 X-Cell 0.0014227642276422765 ZDOCK 0.02296747967479675

Year

2023 0.15557746016099885 2024 0.5027106949236076 2025 1.0 2026 0.4775751601774273 2027 0.0

Keywords

target 1.0 potential 0.275963546610974 analysis 0.1923295993924435 docking 0.1853047275488893 visualization 0.16347066641351812 between 0.16062274539586102 energy 0.09948737421682172 novel 0.09208277957091324 cell 0.07081830263907347 promising 0.06759065881906208 binding 0.05458515283842795 performance 0.05069299411429656 stability 0.04233909246250237 activity 0.04195936966014809 experimental 0.034934497816593885 synthesized 0.028669071577748242 mechanism 0.02135940763242833 interaction 0.020220239225365484 including 0.01974558572242263 effective 0.01927093221947978 development 0.017752041010062655 enhanced 0.01385988228593127 design 0.005126257831782798 synthesis 0.004461742927662806 strong 0.0
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