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Application

Discovery Studio 0.9972353228167181 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0633844927247359 Amorphous Cell 0.2794498704405023 Blends 0.001993223041658362 CASTEP 0.33506079330277055 CDOCKER 0.16782938010763404 CHARMm 0.26868646601554713 COMPASS 0.3396452062985848 COMPASS III 0.1030496312537373 COSMObase 0.004584412995814232 COSMOconf 0.0055810245166434125 COSMOmic 0.0 COSMOperm 3.9864460833167234E-4 COSMOplex 1.9932230416583617E-4 COSMOquick 0.001195933824995017 COSMOtherm 0.06477974885389676 Catalyst 0.08311740083715367 Classical Simulations 1.0 Conformers 3.9864460833167234E-4 Crystallization 0.07075941797887184 DFTB Plus 0.0035878014749850507 DMol3 0.152082918078533 DPD 0.0021925453458241976 Discover 0.003986446083316724 Forcite 0.5228224038269882 GULP 0.01973290811241778 Kinetix 1.9932230416583617E-4 LUDI 0.003986446083316724 LibDock 0.07175602949970102 LigandFit 0.003986446083316724 MCSS 5.979669124975084E-4 MODELER 0.2553318716364361 MesoDyn 7.972892166633447E-4 Mesocite 0.0029898345624875425 Mesoscale 0.005780346820809248 Modules 0.0 Morphology 0.015945784333266894 ONETEP 7.972892166633447E-4 Polymorph 0.0017939007374925253 QMERA 1.9932230416583617E-4 QSAR 5.979669124975084E-4 Quantum Mechanics 0.4773769184771776 Reflex 0.051624476778951565 Reflex Plus 5.979669124975084E-4 Semi-empirical 0.004983057604145904 Sorption 0.054813633645604945 Synthia 0.001195933824995017 TURBOMOLE 1.9932230416583617E-4 VAMP 7.972892166633447E-4 Visualization 0.7087901136137134 X-Cell 0.0017939007374925253 ZDOCK 0.029300378712377916

Year

2023 9.672738997259391E-4 2024 0.4570369176205062 2025 1.0 2026 0.6791874899242302 2027 0.0

Keywords

target 1.0 potential 0.3046673666125799 docking 0.21981483249021666 analysis 0.21609239286055168 visualization 0.1655053927651045 between 0.1467977474467882 novel 0.09344277942159016 promising 0.08237090770258662 energy 0.07626228882313639 binding 0.07301708504342846 cell 0.06108618879450224 activity 0.04638732461582514 stability 0.039610575546435045 performance 0.037510737806624034 including 0.02281187362794693 effective 0.01613057172854825 synthesized 0.01527154719862556 development 0.013267156628805956 mechanism 0.012789920778848907 experimental 0.012121790588909038 interaction 0.01202634341891763 enhanced 0.008972033979192518 strong 0.008208456619261239 protein 0.004008781139639209 design 0.0
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