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Application

Discovery Studio 0.8338195254764683 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06707081129885206 Amorphous Cell 0.29137108216174384 Blends 0.002321681929575648 CASTEP 0.3825615890622985 CDOCKER 0.1438152973042693 CHARMm 0.2335869985811944 COMPASS 0.3656649039081646 COMPASS III 0.09441506513607635 COSMObase 0.00399845221204695 COSMOconf 0.005288275506255643 COSMOmic 1.2898232942086933E-4 COSMOperm 0.0012898232942086935 COSMOplex 2.5796465884173866E-4 COSMOquick 0.001547787953050432 COSMOtherm 0.06655488198116857 Cantera 0.0 Catalyst 0.08732103701792854 Classical Simulations 1.0 Conformers 5.159293176834773E-4 Crystallization 0.0723590868051077 DFTB Plus 0.005675222494518251 DMol3 0.17154649812975623 DPD 0.0024506642589965173 Discover 0.0036115052237843414 Forcite 0.5560428221333678 GULP 0.02154004901328518 Kinetix 2.5796465884173866E-4 LUDI 0.003095575906100864 LibDock 0.062298465110279894 LigandFit 0.0036115052237843414 MCSS 5.159293176834773E-4 MODELER 0.2107571262737005 MesoDyn 7.73893976525216E-4 Mesocite 0.003095575906100864 Mesoscale 0.00593318715335999 Modules 0.0 Morphology 0.016896685154133884 ONETEP 0.001160840964787824 Polymorph 0.0020637172707339093 QMERA 1.2898232942086933E-4 QSAR 9.028763059460854E-4 Quantum Mechanics 0.5431445891912808 Reflex 0.05223784341545208 Reflex Plus 0.001160840964787824 Semi-empirical 0.007094028118147814 Sorption 0.059331871533599895 Synthia 0.0014188056236295627 TURBOMOLE 6.449116471043467E-4 VAMP 0.0010318586353669547 Visualization 0.691087321037018 X-Cell 0.001547787953050432 ZDOCK 0.02515155423706952

Year

2023 0.09078720551618463 2024 0.45824554683010915 2025 1.0 2026 0.4070101513120092 2027 0.0

Keywords

target 1.0 potential 0.28477061996242653 analysis 0.19823041027816496 docking 0.19247318344342768 visualization 0.16380825404520938 between 0.16186897763771893 energy 0.1002363493121629 novel 0.09732743470092722 promising 0.0736925034846373 cell 0.07096539603660384 binding 0.06023877340767226 performance 0.047815283922186536 stability 0.04423974304587601 activity 0.04163384037331071 experimental 0.03199806072359251 synthesized 0.02496818374643961 interaction 0.02454396703230107 including 0.023453124053087693 effective 0.02199866674746985 mechanism 0.020907823768256468 development 0.018968547360766013 enhanced 0.012181079934549421 design 0.003757348039512757 synthesis 0.002181685958426762 protein 0.0
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