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Application

Discovery Studio 0.8349960271916659 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06818988990174027 Amorphous Cell 0.28755771279744285 Blends 0.002604474961524802 CASTEP 0.3948147271220552 CDOCKER 0.146560909198532 CHARMm 0.23452113176275602 COMPASS 0.3671125843494732 COMPASS III 0.0921037054575589 COSMObase 0.004143482893334912 COSMOconf 0.004853794246478039 COSMOmic 1.1838522552385462E-4 COSMOperm 0.0014206227062862555 COSMOplex 2.3677045104770924E-4 COSMOquick 0.0016573931573339647 COSMOtherm 0.06570380016573932 Cantera 0.0 Catalyst 0.09234047590860661 Classical Simulations 1.0 Conformers 7.103113531431277E-4 Crystallization 0.07422753640345685 DFTB Plus 0.005800876050668876 DMol3 0.17568367467740026 DPD 0.002604474961524802 Discover 0.003551556765715639 Forcite 0.5530957736474488 GULP 0.02332188942819936 Kinetix 2.3677045104770924E-4 LUDI 0.0030780158636202204 LibDock 0.06108677637030899 LigandFit 0.003669941991239493 MCSS 3.5515567657156387E-4 MODELER 0.20291227654788682 MesoDyn 9.47081804190837E-4 Mesocite 0.0033147863146679294 Mesoscale 0.006392802178288149 Modules 0.0 Morphology 0.017521013377530485 ONETEP 0.0011838522552385462 Polymorph 0.0021309340594293834 QMERA 1.1838522552385462E-4 QSAR 0.0010654670297146917 Quantum Mechanics 0.5592518053746892 Reflex 0.05374689238783 Reflex Plus 0.0010654670297146917 Semi-empirical 0.007339883982478986 Sorption 0.05931099798745117 Synthia 0.0014206227062862555 TURBOMOLE 5.919261276192731E-4 VAMP 0.0011838522552385462 Visualization 0.706049485024269 X-Cell 0.0015390079318101102 ZDOCK 0.024387356457914053

Year

2023 0.14383192673729575 2024 0.4922786855808942 2025 1.0 2026 0.3815765846651104 2027 0.0

Keywords

target 1.0 potential 0.2838606371818232 analysis 0.19479874109657114 docking 0.19170669758710177 visualization 0.1668047043233394 between 0.15890895036165867 energy 0.09795152117497653 novel 0.09662635967091823 promising 0.0684114626470101 cell 0.0671415162056209 binding 0.058804041742587375 performance 0.045000276075313345 activity 0.04218430787918944 stability 0.041466512064491194 experimental 0.03174866103473027 interaction 0.024736348075755067 synthesized 0.02324554138368947 effective 0.019711777372867317 including 0.01954613218486003 mechanism 0.017282314615427088 development 0.016730163988736127 enhanced 0.007509248522997073 synthesis 0.002539892882778422 design 0.0014908066920655955 protein 0.0
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