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Application

Discovery Studio 0.9905648348846104 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06414133375775903 Amorphous Cell 0.2785293649530479 Blends 0.0020690752825083558 CASTEP 0.3493554034696801 CDOCKER 0.16536686296355244 CHARMm 0.26897978672608625 COMPASS 0.342989017985039 COMPASS III 0.09565494190673245 COSMObase 0.004456469839248766 COSMOconf 0.005252268024828904 COSMOmic 0.0 COSMOperm 6.366385484641095E-4 COSMOplex 1.591596371160274E-4 COSMOquick 0.0014324367340442464 COSMOtherm 0.06430049339487506 Cantera 0.0 Catalyst 0.09454082444692026 Classical Simulations 1.0 Conformers 6.366385484641095E-4 Crystallization 0.06955276141970396 DFTB Plus 0.004297310202132739 DMol3 0.15709056183351902 DPD 0.002228234919624383 Discover 0.0036606716536686295 Forcite 0.5268183988540506 GULP 0.019576635365271367 Kinetix 1.591596371160274E-4 LUDI 0.003819831290784657 LibDock 0.06907528250835589 LigandFit 0.0041381505650167115 MCSS 6.366385484641095E-4 MODELER 0.23221391055228394 MesoDyn 6.366385484641095E-4 Mesocite 0.003342352379436575 Mesoscale 0.005888906573293013 Modules 0.0 Morphology 0.015915963711602737 ONETEP 7.957981855801369E-4 Polymorph 0.001750756008276301 QMERA 1.591596371160274E-4 QSAR 6.366385484641095E-4 Quantum Mechanics 0.49641890816488937 Reflex 0.0506127646028967 Reflex Plus 7.957981855801369E-4 Semi-empirical 0.005729746936176986 Sorption 0.054432595893681365 Synthia 9.549578226961642E-4 TURBOMOLE 3.183192742320548E-4 VAMP 9.549578226961642E-4 Visualization 0.7435938246060799 X-Cell 0.001750756008276301 ZDOCK 0.027375457583956708

Year

2023 0.11331761201439741 2024 0.451284597244632 2025 1.0 2026 0.525629887054735 2027 0.0

Keywords

target 1.0 potential 0.2976110739004242 docking 0.22125474436258094 analysis 0.2080821611966957 visualization 0.1785368757907271 between 0.1497358041229441 novel 0.0963756790950361 energy 0.07925876311676713 promising 0.07375158145419364 binding 0.07092356924908834 cell 0.06013247004539704 activity 0.047183151000967476 stability 0.04078291285257126 performance 0.03363846096598943 including 0.0212100915382898 synthesized 0.02039145642628563 experimental 0.019200714445188657 interaction 0.018605343454640173 effective 0.016447123613901913 development 0.014809853389893577 mechanism 0.013470268661159485 protein 0.009228250353501525 enhanced 0.005507181662573491 synthesis 0.002381483962193942 strong 0.0
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