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Application

Discovery Studio 0.9597534445250181 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060723514211886306 Amorphous Cell 0.2786391042204996 Blends 0.0017226528854435831 CASTEP 0.297588285960379 CDOCKER 0.15719207579672695 CHARMm 0.2588285960378984 COMPASS 0.3415159345391904 COMPASS III 0.1124031007751938 COSMObase 0.0034453057708871662 COSMOconf 0.006459948320413436 COSMOmic 0.0 COSMOperm 8.613264427217916E-4 COSMOplex 4.306632213608958E-4 COSMOquick 0.0 COSMOtherm 0.06416881998277348 Catalyst 0.0719207579672696 Classical Simulations 1.0 Conformers 4.306632213608958E-4 Crystallization 0.08010335917312661 DFTB Plus 0.0034453057708871662 DMol3 0.13695090439276486 DPD 0.002583979328165375 Discover 0.004737295434969853 Forcite 0.532730404823428 GULP 0.012058570198105082 Kinetix 0.0 LUDI 0.0030146425495262705 LibDock 0.06459948320413436 LigandFit 0.002583979328165375 MODELER 0.2368647717484927 Mesocite 0.003875968992248062 Mesoscale 0.006029285099052541 Morphology 0.018518518518518517 ONETEP 8.613264427217916E-4 Polymorph 0.0012919896640826874 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4280792420327304 Reflex 0.05857019810508183 Reflex Plus 4.306632213608958E-4 Semi-empirical 0.004737295434969853 Sorption 0.056847545219638244 Synthia 8.613264427217916E-4 TURBOMOLE 0.0 VAMP 4.306632213608958E-4 Visualization 0.6688199827734711 X-Cell 0.0012919896640826874 ZDOCK 0.02627045650301464

Year

2024 0.06373397990994112 2025 0.9605126428818843 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.3182537887355802 analysis 0.2282289074869939 docking 0.22257407826283646 visualization 0.16693055869712733 between 0.13594209454874462 promising 0.09296539244514816 novel 0.08821533589685591 binding 0.07803664329337254 energy 0.07057226871748473 cell 0.06401266681746211 performance 0.0486315313277539 stability 0.04772675865188871 activity 0.04704817914498982 strong 0.031214657317349015 including 0.027143180275955667 strategy 0.021488351051798235 enhanced 0.01945261253110156 mechanism 0.01877403302420267 effective 0.01538113548970821 development 0.012666817462112644 synthesized 0.011309658448314861 design 0.002035738520696675 experimental 0.002035738520696675 therapeutic 0.0
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