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Application

Discovery Studio 0.850242446848191 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06651802303976218 Amorphous Cell 0.28700606961476527 Blends 0.002601263470828688 CASTEP 0.38882695404434536 CDOCKER 0.14876749659358354 CHARMm 0.23844915149262974 COMPASS 0.36405301622692926 COMPASS III 0.09438870308435526 COSMObase 0.004335439118047814 COSMOconf 0.004954787563483215 COSMOmic 1.238696890870804E-4 COSMOperm 0.0013625665799578844 COSMOplex 1.238696890870804E-4 COSMOquick 0.0014864362690449647 COSMOtherm 0.06552706552706553 Cantera 0.0 Catalyst 0.09141583054626533 Classical Simulations 1.0 Conformers 7.432181345224824E-4 Crystallization 0.07357859531772576 DFTB Plus 0.005574136008918618 DMol3 0.1736653041000867 DPD 0.0024773937817416077 Discover 0.003592220983525331 Forcite 0.5520872042611173 GULP 0.022792022792022793 Kinetix 2.477393781741608E-4 LUDI 0.00309674222717701 LibDock 0.06280193236714976 LigandFit 0.0038399603616994923 MCSS 3.716090672612412E-4 MODELER 0.20921590486807878 MesoDyn 9.909575126966432E-4 Mesocite 0.00322061191626409 Mesoscale 0.0063173541434411 Modules 0.0 Morphology 0.017465626161278336 ONETEP 0.0011148272017837235 Polymorph 0.0021057847144803667 QMERA 1.238696890870804E-4 QSAR 9.909575126966432E-4 Quantum Mechanics 0.5510962467484206 Reflex 0.053263966307444566 Reflex Plus 0.0011148272017837235 Semi-empirical 0.007184441967050662 Sorption 0.058342623560014864 Synthia 0.0012386968908708038 TURBOMOLE 3.716090672612412E-4 VAMP 0.0012386968908708038 Visualization 0.7033320946364424 X-Cell 0.001610305958132045 ZDOCK 0.02440232875015484

Year

2023 0.11840411840411841 2024 0.4626769626769627 2025 1.0 2026 0.39069681926824784 2027 0.0

Keywords

target 1.0 potential 0.28637842863784285 analysis 0.19705950720595072 docking 0.1946187819618782 visualization 0.1655625290562529 between 0.15678754067875406 novel 0.09669920966992096 energy 0.09565318456531846 promising 0.0695025569502557 cell 0.06671315667131567 binding 0.05979776847977685 performance 0.0451534170153417 activity 0.04178289167828917 stability 0.04062064156206416 experimental 0.028475127847512785 interaction 0.022663877266387727 synthesized 0.022198977219897723 including 0.019583914458391447 effective 0.018712226871222686 development 0.016213389121338913 mechanism 0.015922826592282658 enhanced 0.007845188284518828 synthesis 0.0020920502092050207 design 0.0010460251046025104 protein 0.0
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