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Application

Discovery Studio 1.0 Materials Studio 0.549899531145345 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06835722160970231 Amorphous Cell 0.1659316427783903 CASTEP 0.3412348401323043 CDOCKER 0.1730981256890849 CHARMm 0.3164277839029768 COMPASS 0.2364939360529217 COMPASS III 0.03362734288864388 COSMObase 0.0011025358324145535 COSMOconf 0.0011025358324145535 COSMOperm 0.0 COSMOquick 5.512679162072767E-4 COSMOtherm 0.04189636163175303 Catalyst 0.11190738699007717 Classical Simulations 0.7690187431091511 Conformers 0.0 Crystallization 0.03638368246968027 DFTB Plus 0.0027563395810363835 DMol3 0.13395810363836824 DPD 0.0 Discover 0.0011025358324145535 Forcite 0.3092613009922823 GULP 0.018743109151047408 LUDI 0.003858875413450937 LibDock 0.08875413450937156 LigandFit 0.002205071664829107 MODELER 0.2464167585446527 Mesocite 5.512679162072767E-4 Mesoscale 5.512679162072767E-4 Modules 0.0 Morphology 0.012127894156560088 Polymorph 0.0011025358324145535 QMERA 0.0 QSAR 0.002205071664829107 Quantum Mechanics 0.4625137816979052 Reflex 0.021499448732083794 Reflex Plus 0.0 Semi-empirical 0.004961411245865491 Sorption 0.027563395810363836 VAMP 0.0011025358324145535 Visualization 1.0 X-Cell 5.512679162072767E-4 ZDOCK 0.029217199558985666

Year

2021 0.0 2022 0.25698663426488455 2023 0.43317132442284323 2024 1.0 2025 0.9198055893074119 2026 0.26123936816524906

Keywords

analysis 1.0 target 0.938265556099951 potential 0.38045075943165113 docking 0.3750612444879961 visualization 0.25796178343949044 between 0.15066144047035768 binding 0.1359627633512984 novel 0.08892699657030867 interaction 0.07520823125918667 protein 0.07349338559529642 activity 0.052670259676629104 energy 0.05169034786869182 including 0.044585987261146494 promising 0.03895149436550711 stability 0.038461538461538464 silico 0.028417442430181284 drug 0.014698677119059285 experimental 0.014208721215090642 mechanism 0.012983831455169036 compound 0.008329250367466928 effective 0.00514453699167075 therapeutic 0.004409603135717786 vitro 0.0026947574718275357 cell 0.001224889759921607 development 0.0
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