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Application

Discovery Studio 1.0 Materials Studio 0.9966392830470501 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0647568608570053 Amorphous Cell 0.2778045257583052 Blends 0.002407318247472316 CASTEP 0.3765045739046702 CDOCKER 0.16658642272508425 CHARMm 0.2637217140105922 COMPASS 0.3514684641309581 COMPASS III 0.09099662975445354 COSMObase 0.004212806933076553 COSMOconf 0.004814636494944632 COSMOmic 1.2036591237361579E-4 COSMOperm 0.001203659123736158 COSMOplex 1.2036591237361579E-4 COSMOquick 0.0015647568608570053 COSMOtherm 0.06307173808377467 Cantera 0.0 Catalyst 0.11133846894559461 Classical Simulations 1.0 Conformers 7.221954742416948E-4 Crystallization 0.07101588830043332 DFTB Plus 0.0055368319691863266 DMol3 0.16803081367356765 DPD 0.0021665864227250844 Discover 0.003370245546461242 Forcite 0.533822821376986 GULP 0.02202696196437169 Kinetix 2.4073182474723158E-4 LUDI 0.0036109773712084737 LibDock 0.07053442465093886 LigandFit 0.004212806933076553 MCSS 4.8146364949446316E-4 MODELER 0.21364949446316803 MesoDyn 8.425613866153105E-4 Mesocite 0.003009147809340395 Mesoscale 0.005657197881559942 Modules 0.0 Morphology 0.016490129995185364 ONETEP 0.0010832932113625422 Polymorph 0.0019258545979778526 QMERA 1.2036591237361579E-4 QSAR 8.425613866153105E-4 Quantum Mechanics 0.5331006259027443 Reflex 0.05175734232065479 Reflex Plus 0.0010832932113625422 Semi-empirical 0.006981222917669716 Sorption 0.056692344727973035 Synthia 0.0013240250361097737 TURBOMOLE 3.610977371208474E-4 VAMP 0.0010832932113625422 Visualization 0.8040442946557534 X-Cell 0.0015647568608570053 ZDOCK 0.027563793933558015

Year

2022 0.0 2023 0.2435814852305144 2024 0.48237784117051624 2025 1.0 2026 0.3918284715192786 2027 7.361737370019325E-4

Keywords

target 1.0 potential 0.29427616686428804 docking 0.22571952139700335 analysis 0.20367575724911072 visualization 0.19763932305702275 between 0.15506090330925945 novel 0.10326614207179045 energy 0.08591139376953756 binding 0.07335345478064029 promising 0.0697423736121591 cell 0.06262800474291258 activity 0.05384283712407028 stability 0.03961409938557724 performance 0.032607523984046566 interaction 0.03099062196830872 synthesized 0.028187991807696454 experimental 0.02533146491322626 including 0.02053465559987065 development 0.019780101325859653 effective 0.01951061765657001 mechanism 0.01870216664870109 protein 0.016276813625094318 synthesis 0.009378031691279508 design 0.001778592217311631 enhanced 0.0
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