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Application

Discovery Studio 0.9189847455454428 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0695057560806717 Amorphous Cell 0.2809659828615944 Blends 0.002683285726651086 CASTEP 0.41071583138578727 CDOCKER 0.15952566432961135 CHARMm 0.24478490435384748 COMPASS 0.3760062321474942 COMPASS III 0.07894053492599325 COSMObase 0.0032026313511641998 COSMOconf 0.0037219769756773134 COSMOmic 1.7311520817103783E-4 COSMOperm 0.0012118064571972648 COSMOplex 2.5967281225655674E-4 COSMOquick 0.0013849216653683027 COSMOtherm 0.06457197264779711 Cantera 8.655760408551892E-5 Catalyst 0.11546784385008223 Classical Simulations 1.0 Conformers 0.001038691249026227 Crystallization 0.07660347961568424 DFTB Plus 0.005885917077815286 DMol3 0.18774344326149053 DPD 0.0027698433307366053 Discover 0.004414437808361465 Forcite 0.5418506015753484 GULP 0.026573184454254307 Kinetix 2.5967281225655674E-4 LUDI 0.004587553016532502 LibDock 0.06690902795810612 LigandFit 0.005799359473729767 MCSS 9.52133644940708E-4 MODELER 0.18012637410196486 MesoDyn 0.0015580368735393405 Mesocite 0.003895092183848351 Mesoscale 0.007270838743183588 Modules 0.0 Morphology 0.01826365446204449 ONETEP 0.0011252488531117459 Polymorph 0.001990824893966935 QMERA 1.7311520817103783E-4 QSAR 0.0012118064571972648 Quantum Mechanics 0.5859084220548775 Reflex 0.05591621223924522 Reflex Plus 7.790184367696703E-4 Semi-empirical 0.00804985717995326 Sorption 0.057041461092356964 Synthia 0.0016445944776248592 TURBOMOLE 6.059032285986324E-4 VAMP 0.001817709685795897 Visualization 0.8040335843503852 X-Cell 0.0012118064571972648 ZDOCK 0.02769843330736605

Year

2020 0.0 2021 0.06929478756022778 2022 0.15076653526062198 2023 0.38957512045554094 2024 0.8412614980289094 2025 1.0 2026 0.37328077091546213 2027 8.760402978537013E-4

Keywords

target 1.0 potential 0.26563923474035833 docking 0.20315821439416945 visualization 0.19256756756756757 analysis 0.18019283328272093 between 0.1550258123291831 novel 0.09634072274521713 energy 0.0901533556027938 binding 0.06312632857576678 cell 0.058533252353477075 promising 0.048967506832675374 activity 0.04388095961129669 interaction 0.03435317339811722 experimental 0.030063771636805344 stability 0.030025812329183117 synthesized 0.026078044336471304 performance 0.026040085028849073 effective 0.01692985119951412 mechanism 0.01658821743091406 development 0.015753112663225023 including 0.011084117825690859 protein 0.011008199210446401 synthesis 0.007629820832068023 chemical 3.036744609778318E-4 design 0.0
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