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Application

Discovery Studio 0.8426996504436677 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06687402799377916 Amorphous Cell 0.2855604737408781 Blends 0.002512262232324441 CASTEP 0.3907165928938868 CDOCKER 0.14774494556765164 CHARMm 0.23699007058260557 COMPASS 0.3672688120588587 COMPASS III 0.09235554492164134 COSMObase 0.004187103720540735 COSMOconf 0.004785261394903696 COSMOmic 1.1963153487259242E-4 COSMOperm 0.0015552099533437014 COSMOplex 1.1963153487259242E-4 COSMOquick 0.0015552099533437014 COSMOtherm 0.06519918650556286 Cantera 0.0 Catalyst 0.09247517645651394 Classical Simulations 1.0 Conformers 7.177892092355545E-4 Crystallization 0.07512860389998803 DFTB Plus 0.005503050604139251 DMol3 0.1749013039837301 DPD 0.002392630697451848 Discover 0.00346931451130518 Forcite 0.5513817442277784 GULP 0.0236870439047733 Kinetix 2.3926306974518484E-4 LUDI 0.003230051441559995 LibDock 0.062328029668620645 LigandFit 0.0038282091159229574 MCSS 3.5889460461777724E-4 MODELER 0.20397176695777006 MesoDyn 0.0010766838138533317 Mesocite 0.003230051441559995 Mesoscale 0.006340471348247398 Modules 0.0 Morphology 0.01782509869601627 ONETEP 0.0010766838138533317 Polymorph 0.002033736092834071 QMERA 1.1963153487259242E-4 QSAR 0.0010766838138533317 Quantum Mechanics 0.5543725325995933 Reflex 0.054551979901902144 Reflex Plus 0.0010766838138533317 Semi-empirical 0.007177892092355545 Sorption 0.0583801890178251 Synthia 0.0013159468835985165 TURBOMOLE 3.5889460461777724E-4 VAMP 0.0013159468835985165 Visualization 0.7055867926785501 X-Cell 0.0015552099533437014 ZDOCK 0.02476372771862663

Year

2023 0.1401732786137711 2024 0.498312813497492 2025 1.0 2026 0.387688098495212 2027 0.0

Keywords

target 1.0 potential 0.2844596106511524 analysis 0.19450660102931305 docking 0.19277243231147909 visualization 0.16648019691206087 between 0.15646677108972926 energy 0.09644215708212128 novel 0.09599462967106735 promising 0.06774446184828821 cell 0.06617811590959946 binding 0.05834638621615574 performance 0.04480868203177445 activity 0.04134034459610651 stability 0.040669053479525624 experimental 0.029480868203177444 interaction 0.023718952785858134 synthesized 0.022991720742895502 including 0.019467442380845825 effective 0.018684269411501454 mechanism 0.016614455135377043 development 0.016166927724323116 enhanced 0.0064891474602819426 synthesis 0.002349518908033117 protein 2.7970463190870443E-4 design 0.0
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