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Application

Discovery Studio 0.9072093023255814 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.061265387918694535 Amorphous Cell 0.28685943315201834 Blends 0.002004008016032064 CASTEP 0.3246492985971944 CDOCKER 0.15888920698539938 CHARMm 0.250501002004008 COMPASS 0.3418265101631835 COMPASS III 0.11193816203836245 COSMObase 0.004580589750930432 COSMOconf 0.006584597766962496 COSMOmic 0.0 COSMOperm 5.72573718866304E-4 COSMOplex 2.86286859433152E-4 COSMOquick 2.86286859433152E-4 COSMOtherm 0.06842255940452334 Catalyst 0.07357572287432007 Classical Simulations 1.0 Conformers 5.72573718866304E-4 Crystallization 0.07586601774978528 DFTB Plus 0.0028628685943315204 DMol3 0.1491554537646722 DPD 0.002290294875465216 Discover 0.0037217291726309764 Forcite 0.540509590609791 GULP 0.015745777268823362 Kinetix 2.86286859433152E-4 LUDI 0.0034354423131978244 LibDock 0.0638419696535929 LigandFit 0.004008016032064128 MCSS 0.0 MODELER 0.23246492985971945 MesoDyn 0.0 Mesocite 0.0031491554537646724 Mesoscale 0.005439450329229888 Morphology 0.017463498425422275 ONETEP 0.001145147437732608 Polymorph 0.0014314342971657602 QMERA 2.86286859433152E-4 QSAR 2.86286859433152E-4 Quantum Mechanics 0.4660750071571715 Reflex 0.055253363870598336 Reflex Plus 2.86286859433152E-4 Semi-empirical 0.004866876610363584 Sorption 0.05926137990266247 Synthia 0.001145147437732608 TURBOMOLE 0.0 VAMP 0.001145147437732608 Visualization 0.6550243343830519 X-Cell 0.002004008016032064 ZDOCK 0.026052104208416832

Year

2024 0.2304168575355016 2025 1.0 2026 0.8117269812185066 2027 0.0

Keywords

target 1.0 potential 0.29841726618705033 analysis 0.21223021582733814 docking 0.2041726618705036 visualization 0.15165467625899282 between 0.14258992805755397 novel 0.08489208633093526 promising 0.08388489208633093 energy 0.079568345323741 cell 0.06287769784172662 binding 0.06230215827338129 performance 0.0520863309352518 stability 0.04158273381294964 activity 0.03784172661870504 including 0.021870503597122302 enhanced 0.018848920863309353 strong 0.016402877697841725 experimental 0.016258992805755396 mechanism 0.015971223021582735 synthesized 0.014532374100719425 development 0.012517985611510792 effective 0.012086330935251799 strategy 0.00920863309352518 design 0.0018705035971223023 interaction 0.0
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