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Application

Discovery Studio 1.0 Materials Studio 0.8763111023154562 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057621791513881616 Amorphous Cell 0.2676794133053955 Blends 0.002357255107386066 CASTEP 0.30251440544787844 CDOCKER 0.18648507071765322 CHARMm 0.2975379779989523 COMPASS 0.32687270822420117 COMPASS III 0.10110005238344683 COSMObase 0.00497642744892614 COSMOconf 0.005500261917234154 COSMOmic 0.0 COSMOperm 5.238344683080147E-4 COSMOplex 2.6191723415400735E-4 COSMOquick 7.85751702462022E-4 COSMOtherm 0.062336301728653745 Catalyst 0.08407543216343635 Classical Simulations 1.0 Conformers 5.238344683080147E-4 Crystallization 0.07045573598742798 DFTB Plus 0.0034049240440020955 DMol3 0.14667365112624411 DPD 0.002881089575694081 Discover 0.00497642744892614 Forcite 0.5034049240440021 GULP 0.01650078575170246 Kinetix 0.0 LUDI 0.004452592980618125 LibDock 0.07595599790466212 LigandFit 0.004452592980618125 MCSS 0.0 MODELER 0.2752750130958617 MesoDyn 5.238344683080147E-4 Mesocite 0.003143006809848088 Mesoscale 0.006286013619696176 Morphology 0.015976951283394446 ONETEP 7.85751702462022E-4 Polymorph 0.002357255107386066 QMERA 2.6191723415400735E-4 QSAR 5.238344683080147E-4 Quantum Mechanics 0.44133053954950235 Reflex 0.05107386066003143 Reflex Plus 5.238344683080147E-4 Semi-empirical 0.004714510214772132 Sorption 0.0534311157674175 Synthia 7.85751702462022E-4 TURBOMOLE 0.0 VAMP 5.238344683080147E-4 Visualization 0.7435830277632268 X-Cell 0.0013095861707700367 ZDOCK 0.030382399161864852

Year

2024 0.37846222025260357 2025 1.0 2026 0.8807888322623532 2027 0.0

Keywords

target 1.0 potential 0.32468694096601075 docking 0.25019166879631993 analysis 0.23370815231280348 visualization 0.17876309736774854 between 0.14221824686940965 novel 0.09608995655507284 promising 0.09430104778941988 binding 0.08778430871454128 energy 0.06043956043956044 activity 0.056989522105801174 cell 0.056989522105801174 stability 0.04012266802964477 performance 0.025683618706874523 including 0.02363915154612829 strong 0.017761308458982876 effective 0.016355737285969844 synthesized 0.015972399693329926 development 0.015333503705596729 mechanism 0.009966777408637873 protein 0.006900076667518528 interaction 0.005877843087145413 enhanced 0.005750063889598774 therapeutic 0.001277791975466394 experimental 0.0
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