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Application

Discovery Studio 0.840217039196631 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06909328683522233 Amorphous Cell 0.28716216216216217 Blends 0.0026155187445510027 CASTEP 0.3938535309503051 CDOCKER 0.1458151700087184 CHARMm 0.23332606800348735 COMPASS 0.3703138622493461 COMPASS III 0.08849171752397558 COSMObase 0.003923278116826504 COSMOconf 0.004468177855274629 COSMOmic 1.0897994768962511E-4 COSMOperm 0.0014167393199651264 COSMOplex 2.1795989537925023E-4 COSMOquick 0.0015257192676547515 COSMOtherm 0.06451612903225806 Cantera 0.0 Catalyst 0.0967741935483871 Classical Simulations 1.0 Conformers 8.718395815170009E-4 Crystallization 0.07650392327811682 DFTB Plus 0.005557977332170881 DMol3 0.17872711421098517 DPD 0.0026155187445510027 Discover 0.0033783783783783786 Forcite 0.553182214472537 GULP 0.024193548387096774 Kinetix 3.2693984306887534E-4 LUDI 0.0034873583260680036 LibDock 0.06179163034001744 LigandFit 0.004141238012205754 MCSS 4.3591979075850045E-4 MODELER 0.1910418482999128 MesoDyn 0.001089799476896251 Mesocite 0.003814298169136879 Mesoscale 0.006756756756756757 Modules 0.0 Morphology 0.017763731473408893 ONETEP 0.001089799476896251 Polymorph 0.001961639058413252 QMERA 1.0897994768962511E-4 QSAR 9.80819529206626E-4 Quantum Mechanics 0.5612467306015693 Reflex 0.056015693112467305 Reflex Plus 9.80819529206626E-4 Semi-empirical 0.007301656495204882 Sorption 0.05928509154315606 Synthia 0.0014167393199651264 TURBOMOLE 6.538796861377507E-4 VAMP 0.0014167393199651264 Visualization 0.7239537925021796 X-Cell 0.0014167393199651264 ZDOCK 0.02452048823016565

Year

2022 8.89284126278346E-5 2023 0.22098710538016897 2024 0.5805246776345042 2025 1.0 2026 0.37803468208092483 2027 0.0

Keywords

target 1.0 potential 0.27806920205790375 docking 0.19075960859477453 analysis 0.1902552204176334 visualization 0.17234944012912337 between 0.15792393826288711 energy 0.09603550892767074 novel 0.09482497730253203 cell 0.06516695248663372 promising 0.061888429335216384 binding 0.05634015938666398 activity 0.03994754362957732 performance 0.03989710481186321 stability 0.038585695551296276 experimental 0.030969434076465248 interaction 0.02738827801876324 synthesized 0.02426107132048825 effective 0.018611923736507618 including 0.017098759205084232 mechanism 0.016846565116513668 development 0.015888227579945527 synthesis 0.0026732573388479775 enhanced 0.0016644809845657218 protein 0.0010592151719963684 design 0.0
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