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Application

Discovery Studio 0.8988244750326535 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06669297553275454 Amorphous Cell 0.2838726650881347 Blends 0.0023677979479084454 CASTEP 0.3851617995264404 CDOCKER 0.15574848724019993 CHARMm 0.2494080505130229 COMPASS 0.35780057879505395 COMPASS III 0.09194948697711129 COSMObase 0.003946329913180742 COSMOconf 0.005130228887134964 COSMOmic 1.3154433043935807E-4 COSMOperm 0.0014469876348329387 COSMOplex 2.6308866087871614E-4 COSMOquick 0.0017100762957116549 COSMOtherm 0.06629834254143646 Cantera 0.0 Catalyst 0.09760589318600368 Classical Simulations 1.0 Conformers 7.892659826361484E-4 Crystallization 0.072744014732965 DFTB Plus 0.006182583530649829 DMol3 0.17087608524072612 DPD 0.0027624309392265192 Discover 0.0034201525914233097 Forcite 0.5444619836885031 GULP 0.022888713496448304 Kinetix 2.6308866087871614E-4 LUDI 0.0031570639305445935 LibDock 0.06577216521967903 LigandFit 0.0040778742436201 MCSS 5.261773217574323E-4 MODELER 0.21310181531176006 MesoDyn 7.892659826361484E-4 Mesocite 0.0030255196001052354 Mesoscale 0.006051039200210471 Modules 0.0 Morphology 0.017232307287555905 ONETEP 0.0013154433043935806 Polymorph 0.002104709287029729 QMERA 0.0 QSAR 0.0010523546435148646 Quantum Mechanics 0.5449881610102605 Reflex 0.052486187845303865 Reflex Plus 0.0010523546435148646 Semi-empirical 0.007761115495922126 Sorption 0.058931860036832415 Synthia 0.0014469876348329387 TURBOMOLE 6.577216521967903E-4 VAMP 0.0013154433043935806 Visualization 0.7283609576427256 X-Cell 0.0015785319652722968 ZDOCK 0.026177321757432256

Year

2023 0.12690451405318445 2024 0.47553704930443835 2025 1.0 2026 0.3309359326204221 2027 0.0

Keywords

target 1.0 potential 0.2695715979003217 docking 0.1898176892250381 analysis 0.18140768753174916 visualization 0.1597900321724897 between 0.14500197550375346 novel 0.09431619348648192 energy 0.0852853191849636 promising 0.06513518089970086 binding 0.06050685782017272 cell 0.060168200033865776 activity 0.04351752554044139 stability 0.03522040977592143 performance 0.03437376531015409 experimental 0.025230005079866794 synthesized 0.024270474685330473 interaction 0.02246429982502681 including 0.018908393068803972 effective 0.01840040638934357 development 0.017497318959191738 mechanism 0.015239600383812158 synthesis 0.006547383868600779 protein 0.004458994186374668 enhanced 0.003781678613760795 design 0.0
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