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Application

Discovery Studio 1.0 Materials Studio 0.7415611814345991 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06683168316831684 Amorphous Cell 0.21947194719471946 CASTEP 0.38696369636963696 CDOCKER 0.1806930693069307 CHARMm 0.29125412541254125 COMPASS 0.3292079207920792 COMPASS III 0.06435643564356436 COSMObase 0.0016501650165016502 COSMOconf 0.0049504950495049506 COSMOperm 0.0024752475247524753 COSMOquick 8.250825082508251E-4 COSMOtherm 0.07590759075907591 Catalyst 0.13613861386138615 Classical Simulations 0.9323432343234324 Conformers 0.0 Crystallization 0.07095709570957096 DFTB Plus 0.004125412541254125 DMol3 0.15181518151815182 DPD 0.0016501650165016502 Discover 0.004125412541254125 Forcite 0.45874587458745875 GULP 0.028877887788778877 Kinetix 0.0 LUDI 0.0024752475247524753 LibDock 0.07755775577557755 LigandFit 0.009075907590759076 MCSS 0.0 MODELER 0.22112211221122113 MesoDyn 0.0016501650165016502 Mesocite 0.0 Mesoscale 0.004125412541254125 Morphology 0.010726072607260726 Polymorph 0.0016501650165016502 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.5313531353135313 Reflex 0.057755775577557754 Semi-empirical 0.007425742574257425 Sorption 0.05033003300330033 Synthia 8.250825082508251E-4 TURBOMOLE 0.0 VAMP 0.0016501650165016502 Visualization 1.0 X-Cell 0.0 ZDOCK 0.03382838283828383

Year

2021 0.0 2022 0.18350848827809216 2023 0.4349232012934519 2024 0.8682295877122069 2025 1.0 2026 0.28455941794664513

Keywords

well 1.0 target 0.9470198675496688 potential 0.2950331125827815 docking 0.2675496688741722 visualization 0.21754966887417218 analysis 0.19370860927152317 between 0.1509933774834437 binding 0.09470198675496688 novel 0.09072847682119205 activity 0.06556291390728476 energy 0.04304635761589404 experimental 0.03708609271523179 promising 0.03708609271523179 cell 0.03245033112582781 interaction 0.031125827814569535 including 0.02847682119205298 synthesized 0.025827814569536423 protein 0.023178807947019868 stability 0.01456953642384106 development 0.010927152317880795 effective 0.010264900662251655 mechanism 0.009602649006622516 vitro 0.004304635761589404 drug 0.0033112582781456954 synthesis 0.0
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