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Application

Discovery Studio 1.0 Materials Studio 0.9908376963350786 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06559981840880717 Amorphous Cell 0.2765860855748496 Blends 0.0024968789013732834 CASTEP 0.3802065599818409 CDOCKER 0.16649642492339123 CHARMm 0.2641016910679832 COMPASS 0.3531948700488026 COMPASS III 0.08863920099875156 COSMObase 0.00397230734309386 COSMOconf 0.004766768811712632 COSMOmic 1.1349449551696743E-4 COSMOperm 0.001361933946203609 COSMOplex 2.2698899103393486E-4 COSMOquick 0.001588922937237544 COSMOtherm 0.06367041198501873 Cantera 0.0 Catalyst 0.11735330836454431 Classical Simulations 1.0 Conformers 6.809669731018045E-4 Crystallization 0.07172852116672342 DFTB Plus 0.005674724775848372 DMol3 0.16842583134717967 DPD 0.0026103733968902507 Discover 0.0034048348655090228 Forcite 0.5324026784700941 GULP 0.022358415616842583 Kinetix 2.2698899103393486E-4 LUDI 0.003745318352059925 LibDock 0.07127454318465555 LigandFit 0.004766768811712632 MCSS 4.5397798206786973E-4 MODELER 0.20576552037226195 MesoDyn 9.079559641357395E-4 Mesocite 0.003177845874475088 Mesoscale 0.006242197253433208 Modules 0.0 Morphology 0.01679718533651118 ONETEP 0.0011349449551696742 Polymorph 0.0020429009193054137 QMERA 1.1349449551696743E-4 QSAR 0.0010214504596527069 Quantum Mechanics 0.5377369197593916 Reflex 0.05209397344228805 Reflex Plus 0.0010214504596527069 Semi-empirical 0.007150153217568948 Sorption 0.056747247758483714 Synthia 0.0014754284417205765 TURBOMOLE 5.674724775848371E-4 VAMP 0.0011349449551696742 Visualization 0.8175008512087164 X-Cell 0.0014754284417205765 ZDOCK 0.028373623879241857

Year

2022 5.383580080753701E-4 2023 0.3048900852400179 2024 0.5124270973530731 2025 1.0 2026 0.3813369223867205 2027 0.0

Keywords

target 1.0 potential 0.2926755752034562 docking 0.2279714658896815 visualization 0.20335577212900632 analysis 0.2014467999598111 between 0.15613382899628253 novel 0.10554606651260927 energy 0.08736059479553904 binding 0.076760775645534 promising 0.06852205365216518 cell 0.06445292876519643 activity 0.05681704008841555 stability 0.04054054054054054 interaction 0.03566763789812117 performance 0.03275394353461268 synthesized 0.030644026926554806 experimental 0.029036471415653572 development 0.02300813824977394 effective 0.02275695770119562 including 0.02150105495830403 mechanism 0.021199638300010048 protein 0.020245152215412437 synthesis 0.013362805184366522 design 0.004571485984125389 enhanced 0.0
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