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Application

Discovery Studio 0.9690598968663229 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.056557776694295465 Amorphous Cell 0.28230131643100925 Blends 0.0024378352023403218 CASTEP 0.32325694783032666 CDOCKER 0.16942954656265236 CHARMm 0.26036079960994635 COMPASS 0.34446611409068745 COMPASS III 0.10945880058508045 COSMObase 0.004388103364212579 COSMOconf 0.005363237445148708 COSMOmic 0.0 COSMOperm 2.4378352023403217E-4 COSMOplex 2.4378352023403217E-4 COSMOquick 7.313505607020966E-4 COSMOtherm 0.06338371526084836 Catalyst 0.08191126279863481 Classical Simulations 1.0 Conformers 4.8756704046806434E-4 Crystallization 0.0726474890297416 DFTB Plus 0.0048756704046806435 DMol3 0.15065821550463188 DPD 0.0024378352023403218 Discover 0.0029254022428083864 Forcite 0.5329107752315944 GULP 0.017796196977084348 Kinetix 2.4378352023403217E-4 LUDI 0.0024378352023403218 LibDock 0.06850316918576305 LigandFit 0.0039005363237445147 MODELER 0.24256460263286203 MesoDyn 0.0 Mesocite 0.0031691857630424185 Mesoscale 0.005363237445148708 Modules 0.0 Morphology 0.01657727937591419 ONETEP 0.0012189176011701609 Polymorph 0.002681618722574354 QMERA 2.4378352023403217E-4 QSAR 2.4378352023403217E-4 Quantum Mechanics 0.4661140906874695 Reflex 0.05192588980984886 Reflex Plus 9.751340809361287E-4 Semi-empirical 0.006338371526084837 Sorption 0.06143344709897611 Synthia 0.0012189176011701609 TURBOMOLE 2.4378352023403217E-4 VAMP 7.313505607020966E-4 Visualization 0.6986835689907362 X-Cell 0.0012189176011701609 ZDOCK 0.02779132130667967

Year

2023 1.913143294432753E-4 2024 0.36694088387220203 2025 1.0 2026 0.6793571838530706 2027 0.0

Keywords

target 1.0 potential 0.3035904728048347 docking 0.21566536319469132 analysis 0.21507287593316743 visualization 0.16637042303590474 between 0.14515937907334991 novel 0.09467946439151559 promising 0.084962673302524 energy 0.08140774973338073 binding 0.06872852233676977 cell 0.06434411660149307 activity 0.05000592487261524 performance 0.04526602678042422 stability 0.039459651617490224 including 0.025121459888612394 synthesized 0.020974049057945254 development 0.01824860765493542 mechanism 0.01824860765493542 effective 0.01718213058419244 experimental 0.016826638227278114 enhanced 0.013390212110439625 strong 0.009835288541296363 interaction 0.009242801279772485 protein 2.369949046095509E-4 strategy 0.0
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