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Application

Discovery Studio 0.497235219055721 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.016998341625207296 Amorphous Cell 0.8656716417910447 Blends 8.291873963515755E-4 CASTEP 0.06592039800995025 CDOCKER 0.07131011608623548 CHARMm 0.09494195688225539 COMPASS 0.47388059701492535 COMPASS III 0.13598673300165837 COSMObase 0.0 COSMOconf 0.0 COSMOperm 8.291873963515755E-4 COSMOquick 4.1459369817578774E-4 COSMOtherm 0.008706467661691543 Cantera 0.0 Catalyst 0.04311774461028192 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.026533996683250415 DFTB Plus 0.002902155887230514 DMol3 0.0439469320066335 DPD 0.0020729684908789387 Discover 0.00912106135986733 Forcite 0.7155887230514096 GULP 0.0037313432835820895 LUDI 0.0 LibDock 0.03316749585406302 LigandFit 4.1459369817578774E-4 MODELER 0.08043117744610281 MesoDyn 0.0012437810945273632 Mesocite 0.001658374792703151 Mesoscale 0.00538971807628524 Modules 0.0 Morphology 0.012023217247097845 QSAR 0.0 Quantum Mechanics 0.1077943615257048 Reflex 0.01285240464344942 Reflex Plus 0.0 Semi-empirical 0.0037313432835820895 Sorption 0.0406301824212272 Synthia 0.001658374792703151 VAMP 4.1459369817578774E-4 Visualization 0.23507462686567165 X-Cell 0.0041459369817578775 ZDOCK 0.021144278606965175

Year

2023 0.046499198289684664 2024 0.3399251737039017 2025 1.0 2026 0.518439337252806 2027 0.0

Keywords

cell 1.0 target 0.9196370706416073 amorphous 0.5187945560596241 between 0.19539857420609202 potential 0.19539857420609202 analysis 0.13674659753726506 energy 0.1286454957874271 performance 0.11276733635774465 docking 0.08003888528839923 mechanism 0.07031756318859365 novel 0.06545690213869086 experimental 0.05119896305897602 enhanced 0.046662346079066754 promising 0.04050550874918989 interaction 0.03856124432922878 visualization 0.026895657809462088 development 0.020414776409591703 design 0.019442644199611146 temperature 0.017174335709656513 effective 0.015554115359688918 stability 0.005184705119896306 strategy 0.004212572909915748 water 9.721322099805574E-4 including 6.480881399870382E-4 binding 0.0
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