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Application

Discovery Studio 0.9814662273476112 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.09337506520605113 Amorphous Cell 0.24517475221700574 Blends 0.0036515388628064684 CASTEP 0.30203442879499215 CDOCKER 0.1585811163275952 CHARMm 0.2509128847157016 COMPASS 0.38028169014084506 COMPASS III 0.07616066770996348 COSMObase 0.0 COSMOconf 0.003129890453834116 COSMOmic 0.0 COSMOperm 5.216484089723526E-4 COSMOplex 0.0 COSMOquick 0.0010432968179447052 COSMOtherm 0.051643192488262914 Catalyst 0.13249869587897756 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.059989567031820554 DFTB Plus 0.004173187271778821 DMol3 0.2102243088158581 DPD 0.0020865936358894104 Discover 0.003129890453834116 Forcite 0.5508607198748043 GULP 0.013041210224308816 Kinetix 0.0 LUDI 0.005738132498695879 LibDock 0.06781429316640585 LigandFit 0.005738132498695879 MODELER 0.1684924360980699 MesoDyn 0.0 Mesocite 0.003129890453834116 Mesoscale 0.006259780907668232 Morphology 0.013562858633281168 ONETEP 0.0 Polymorph 0.0010432968179447052 QSAR 0.0010432968179447052 Quantum Mechanics 0.5033907146583203 Reflex 0.04381846635367762 Reflex Plus 0.0 Semi-empirical 0.006259780907668232 Sorption 0.0505998956703182 Synthia 0.0 TURBOMOLE 5.216484089723526E-4 VAMP 0.001564945226917058 Visualization 0.7709963484611372 X-Cell 0.0 ZDOCK 0.026604068857589983

Year

2021 0.004584527220630372 2022 0.24469914040114613 2023 0.3512893982808023 2024 1.0 2025 0.9822349570200573 2026 0.34326647564469914 2027 0.0

Keywords

effective 1.0 target 0.9452214452214452 potential 0.313986013986014 docking 0.18857808857808858 analysis 0.17692307692307693 visualization 0.15244755244755245 between 0.12773892773892773 novel 0.11421911421911422 promising 0.07109557109557109 energy 0.061072261072261075 development 0.05407925407925408 binding 0.052214452214452214 activity 0.04731934731934732 cell 0.032167832167832165 performance 0.026806526806526808 treatment 0.02564102564102564 synthesized 0.02400932400932401 interaction 0.019813519813519812 stability 0.01888111888111888 strategy 0.014918414918414918 experimental 0.012354312354312355 including 0.006993006993006993 protein 0.006993006993006993 drug 9.324009324009324E-4 efficient 0.0
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