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Application

Discovery Studio 1.0 Materials Studio 0.9223509933774835 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05701943844492441 Amorphous Cell 0.2751619870410367 Blends 0.0023758099352051837 CASTEP 0.3263498920086393 CDOCKER 0.17796976241900647 CHARMm 0.28077753779697623 COMPASS 0.3362850971922246 COMPASS III 0.10323974082073434 COSMObase 0.0045356371490280776 COSMOconf 0.005183585313174946 COSMOmic 0.0 COSMOperm 4.3196544276457883E-4 COSMOplex 2.1598272138228941E-4 COSMOquick 0.0010799136069114472 COSMOtherm 0.06349892008639309 Catalyst 0.09071274298056156 Classical Simulations 1.0 Conformers 4.3196544276457883E-4 Crystallization 0.07084233261339093 DFTB Plus 0.004319654427645789 DMol3 0.14838012958963284 DPD 0.0023758099352051837 Discover 0.0034557235421166306 Forcite 0.5157667386609072 GULP 0.01814254859611231 Kinetix 2.1598272138228941E-4 LUDI 0.0034557235421166306 LibDock 0.0714902807775378 LigandFit 0.004319654427645789 MODELER 0.26479481641468683 MesoDyn 0.0 Mesocite 0.003023758099352052 Mesoscale 0.005183585313174946 Modules 0.0 Morphology 0.016414686825053995 ONETEP 0.0010799136069114472 Polymorph 0.002591792656587473 QMERA 2.1598272138228941E-4 QSAR 4.3196544276457883E-4 Quantum Mechanics 0.4663066954643629 Reflex 0.05075593952483801 Reflex Plus 8.639308855291577E-4 Semi-empirical 0.005615550755939525 Sorption 0.057883369330453564 Synthia 0.0010799136069114472 TURBOMOLE 2.1598272138228941E-4 VAMP 6.479481641468683E-4 Visualization 0.7578833693304535 X-Cell 0.0010799136069114472 ZDOCK 0.03002159827213823

Year

2023 0.017688476730207795 2024 0.45526360982311526 2025 1.0 2026 0.6718186501803194 2027 0.0

Keywords

target 1.0 potential 0.31487747359786733 docking 0.23808059058751155 analysis 0.22065005639290475 visualization 0.18168768584025427 between 0.14098226186814314 novel 0.09873884958474316 promising 0.08571721521583103 binding 0.07895006664616015 energy 0.06920947400799754 cell 0.059673946478006765 activity 0.05639290474725726 stability 0.038859837998564545 performance 0.031272428996206296 including 0.02122423869578591 synthesized 0.019891315492668923 development 0.017635599302778634 effective 0.016302676099661642 mechanism 0.012816569260740285 experimental 0.010560853070849995 interaction 0.01035578796267815 enhanced 0.006869681123756793 protein 0.00676714856967087 strong 0.006049420691069414 synthesis 0.0
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