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Application

Discovery Studio 0.8873396542108198 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06764988778454632 Amorphous Cell 0.2841722774393502 Blends 0.0024580527946991555 CASTEP 0.3998076306508496 CDOCKER 0.15817035374585872 CHARMm 0.24259912365074277 COMPASS 0.3712728438602116 COMPASS III 0.08560436037191407 COSMObase 0.0038473869830073742 COSMOconf 0.003954258843646468 COSMOmic 2.1374372127818745E-4 COSMOperm 0.001175590467030031 COSMOplex 2.1374372127818745E-4 COSMOquick 0.0016030779095864058 COSMOtherm 0.06529870685048626 Cantera 0.0 Catalyst 0.10334508923800363 Classical Simulations 1.0 Conformers 9.618467457518436E-4 Crystallization 0.07566527733247835 DFTB Plus 0.005022977450037405 DMol3 0.1823233942502939 DPD 0.0024580527946991555 Discover 0.004168002564924655 Forcite 0.5440846425136262 GULP 0.02607673399593887 Kinetix 2.1374372127818745E-4 LUDI 0.004274874425563749 LibDock 0.06668804103879448 LigandFit 0.005129849310676499 MCSS 9.618467457518436E-4 MODELER 0.18788073100352679 MesoDyn 0.0014962060489473123 Mesocite 0.003954258843646468 Mesoscale 0.00716041466281928 Modules 0.0 Morphology 0.016992625841615903 ONETEP 9.618467457518436E-4 Polymorph 0.0019236934915036871 QMERA 2.1374372127818745E-4 QSAR 8.549748851127498E-4 Quantum Mechanics 0.5703751202308432 Reflex 0.05610772683552421 Reflex Plus 8.549748851127498E-4 Semi-empirical 0.00716041466281928 Sorption 0.05717644544191514 Synthia 0.0014962060489473123 TURBOMOLE 5.343593031954686E-4 VAMP 0.0017099497702254996 Visualization 0.7587902105375655 X-Cell 0.0013893341883082185 ZDOCK 0.027145452602329808

Year

2021 0.003954172158572442 2022 0.1517793774713576 2023 0.219912805434452 2024 0.7813038629220318 2025 1.0 2026 0.43080198722498225 2027 0.0

Keywords

target 1.0 potential 0.2707362758753182 docking 0.1975409442389895 analysis 0.18615820565774938 visualization 0.18097113491186784 between 0.15556409394361462 novel 0.09797800297776284 energy 0.09346333029153259 cell 0.062196820517746505 binding 0.060948081264108354 promising 0.05595312424955574 activity 0.041928821862542626 performance 0.03549301186302291 stability 0.034724556937707124 interaction 0.03160270880361174 experimental 0.03025791268430911 synthesized 0.0257912684309111 effective 0.01969165746121704 mechanism 0.017098122088276258 development 0.017002065222611787 including 0.014312472984006532 protein 0.008453004178473656 synthesis 0.006003554104029586 design 0.002257336343115124 chemical 0.0
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