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Application

Discovery Studio 0.8606749684172532 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06375227686703097 Amorphous Cell 0.2923497267759563 Blends 0.002276867030965392 CASTEP 0.33765938069216755 CDOCKER 0.1534608378870674 CHARMm 0.24112021857923496 COMPASS 0.35200364298724957 COMPASS III 0.1081511839708561 COSMObase 0.005236794171220401 COSMOconf 0.006602914389799636 COSMOmic 0.0 COSMOperm 4.553734061930783E-4 COSMOplex 2.2768670309653916E-4 COSMOquick 9.107468123861566E-4 COSMOtherm 0.06853369763205829 Catalyst 0.06989981785063752 Classical Simulations 1.0 Conformers 4.553734061930783E-4 Crystallization 0.07331511839708561 DFTB Plus 0.004326047358834244 DMol3 0.15733151183970856 DPD 0.002276867030965392 Discover 0.004553734061930784 Forcite 0.546448087431694 GULP 0.018670309653916212 Kinetix 2.2768670309653916E-4 LUDI 0.004326047358834244 LibDock 0.06284153005464481 LigandFit 0.0036429872495446266 MCSS 2.2768670309653916E-4 MODELER 0.23224043715846995 MesoDyn 6.830601092896175E-4 Mesocite 0.0034153005464480873 Mesoscale 0.006147540983606557 Morphology 0.016621129326047358 ONETEP 9.107468123861566E-4 Polymorph 0.002276867030965392 QMERA 2.2768670309653916E-4 QSAR 6.830601092896175E-4 Quantum Mechanics 0.4870218579234973 Reflex 0.052823315118397086 Reflex Plus 4.553734061930783E-4 Semi-empirical 0.005919854280510018 Sorption 0.05919854280510018 Synthia 0.001138433515482696 TURBOMOLE 4.553734061930783E-4 VAMP 9.107468123861566E-4 Visualization 0.6407103825136612 X-Cell 0.0018214936247723133 ZDOCK 0.026183970856102003

Year

2024 0.2836036036036036 2025 1.0 2026 0.738018018018018 2027 0.0

Keywords

target 1.0 potential 0.2928702430077946 analysis 0.208276020174232 docking 0.19440623567171023 between 0.14500229252636404 visualization 0.1439706556625401 novel 0.08482347546996791 energy 0.08425034387895461 promising 0.08298945437872536 cell 0.06579550664832645 binding 0.05696928014672169 performance 0.05135259055479138 stability 0.0411508482347547 activity 0.03679504814305364 including 0.019715726730857405 enhanced 0.017996331957817514 experimental 0.017537826685006877 strong 0.014328289775332416 effective 0.014099037138927097 mechanism 0.01192113709307657 synthesized 0.011577258138468592 development 0.009170105456212746 strategy 9.170105456212746E-4 design 0.0 interaction 0.0
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