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Application

Discovery Studio 1.0 Materials Studio 0.8932518222431225 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05638524839987809 Amorphous Cell 0.2663822005486132 Blends 0.0024382810118866198 CASTEP 0.29198415117342275 CDOCKER 0.18500457177689728 CHARMm 0.2916793660469369 COMPASS 0.3270344407192929 COMPASS III 0.10911307528192624 COSMObase 0.004571776897287412 COSMOconf 0.0048765620237732395 COSMOmic 0.0 COSMOperm 3.0478512648582747E-4 COSMOplex 3.0478512648582747E-4 COSMOquick 6.095702529716549E-4 COSMOtherm 0.06217616580310881 Catalyst 0.08229198415117342 Classical Simulations 1.0 Conformers 6.095702529716549E-4 Crystallization 0.0731484303565986 DFTB Plus 0.00365742151782993 DMol3 0.14111551356293814 DPD 0.003047851264858275 Discover 0.00365742151782993 Forcite 0.5077720207253886 GULP 0.015544041450777202 Kinetix 3.0478512648582747E-4 LUDI 0.0033526363913441025 LibDock 0.0743675708625419 LigandFit 0.004266991770801585 MODELER 0.2672965559280707 Mesocite 0.00365742151782993 Mesoscale 0.00609570252971655 Modules 0.0 Morphology 0.01584882657726303 ONETEP 0.0012191405059433099 Polymorph 0.0024382810118866198 QMERA 3.0478512648582747E-4 QSAR 0.0 Quantum Mechanics 0.4263943919536727 Reflex 0.053032612008533986 Reflex Plus 9.143553794574825E-4 Semi-empirical 0.0048765620237732395 Sorption 0.057299603779335566 Synthia 9.143553794574825E-4 TURBOMOLE 0.0 VAMP 3.0478512648582747E-4 Visualization 0.7327034440719293 X-Cell 0.0015239256324291375 ZDOCK 0.029564157269125268

Year

2024 0.25697646202378066 2025 1.0 2026 0.8444552293132734 2027 0.0

Keywords

target 1.0 potential 0.3249886894887649 docking 0.24310058814658422 analysis 0.23103604282913587 visualization 0.17599155481827777 between 0.13557532800482583 promising 0.09229377167847987 novel 0.09108731714673503 binding 0.08158648770924445 energy 0.05790981752375207 cell 0.054441260744985676 activity 0.05248077213090031 stability 0.037098476851153674 performance 0.02805006786306741 including 0.024129090634896697 strong 0.017795204343236313 synthesized 0.01417584074800181 effective 0.013120193032725078 development 0.012969386216256975 mechanism 0.010104056703362991 enhanced 0.004675011310511235 interaction 0.004373397677575027 protein 0.003016136329362087 strategy 6.032272658724174E-4 therapeutic 0.0
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