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Application

Discovery Studio 0.8256018054162487 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06535841712617581 Amorphous Cell 0.2917612714888096 Blends 0.0019461563412260785 CASTEP 0.3589036652611093 CDOCKER 0.14677262406746674 CHARMm 0.23580927667855983 COMPASS 0.3602011028219267 COMPASS III 0.10282192669477781 COSMObase 0.0043788517677586765 COSMOconf 0.005676289328576062 COSMOmic 1.621796951021732E-4 COSMOperm 4.8653908530651963E-4 COSMOplex 1.621796951021732E-4 COSMOquick 0.001621796951021732 COSMOtherm 0.0671423937722997 Catalyst 0.07362958157638663 Classical Simulations 1.0 Conformers 3.243593902043464E-4 Crystallization 0.07346740188128446 DFTB Plus 0.004703211157963023 DMol3 0.16250405449237756 DPD 0.0021083360363282518 Discover 0.003405773597145637 Forcite 0.551573143042491 GULP 0.020434641582873826 Kinetix 1.621796951021732E-4 LUDI 0.003243593902043464 LibDock 0.06292572169964321 LigandFit 0.003405773597145637 MCSS 3.243593902043464E-4 MODELER 0.22559195588712294 MesoDyn 6.487187804086928E-4 Mesocite 0.003081414206941291 Mesoscale 0.005514109633473889 Modules 0.0 Morphology 0.01719104768083036 ONETEP 9.730781706130393E-4 Polymorph 0.0021083360363282518 QMERA 1.621796951021732E-4 QSAR 6.487187804086928E-4 Quantum Mechanics 0.5116769380473565 Reflex 0.05303276029841064 Reflex Plus 9.730781706130393E-4 Semi-empirical 0.006162828413882582 Sorption 0.057735971456373665 Synthia 9.730781706130393E-4 TURBOMOLE 3.243593902043464E-4 VAMP 9.730781706130393E-4 Visualization 0.6428803113850146 X-Cell 0.001621796951021732 ZDOCK 0.025948751216347713

Year

2023 4.8828125E-4 2024 0.411865234375 2025 1.0 2026 0.5184326171875 2027 0.0

Keywords

target 1.0 potential 0.2873743718592965 analysis 0.2032035175879397 docking 0.1876570351758794 between 0.15931218592964824 visualization 0.14824120603015076 energy 0.09751884422110553 novel 0.09532035175879397 promising 0.08212939698492462 cell 0.07160804020100503 binding 0.06179334170854271 performance 0.057474874371859296 stability 0.046875 activity 0.038709170854271356 experimental 0.027873743718592966 including 0.024261934673366833 effective 0.023241206030150754 mechanism 0.02127826633165829 synthesized 0.019943467336683417 enhanced 0.019393844221105527 development 0.018530150753768845 interaction 0.015939070351758795 strong 0.0070665829145728646 design 0.0058103015075376884 strategy 0.0
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