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Application

Discovery Studio 0.9433333333333334 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0535031847133758 Amorphous Cell 0.2802547770700637 Blends 0.001910828025477707 CASTEP 0.2554140127388535 CDOCKER 0.16050955414012738 CHARMm 0.25095541401273885 COMPASS 0.3503184713375796 COMPASS III 0.11719745222929936 COSMObase 0.003821656050955414 COSMOconf 0.0070063694267515925 COSMOmic 0.0 COSMOperm 6.369426751592356E-4 COSMOplex 0.0 COSMOtherm 0.06751592356687898 Catalyst 0.07006369426751592 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07579617834394904 DFTB Plus 0.003821656050955414 DMol3 0.12292993630573248 DPD 0.001910828025477707 Discover 0.0044585987261146496 Forcite 0.5363057324840764 GULP 0.012101910828025478 Kinetix 0.0 LUDI 6.369426751592356E-4 LibDock 0.06496815286624204 LigandFit 0.0031847133757961785 MODELER 0.22420382165605096 Mesocite 0.0031847133757961785 Mesoscale 0.0044585987261146496 Morphology 0.015286624203821656 ONETEP 0.0012738853503184713 Polymorph 0.0025477707006369425 QMERA 0.0 Quantum Mechanics 0.3732484076433121 Reflex 0.055414012738853505 Reflex Plus 0.0 Semi-empirical 0.0044585987261146496 Sorption 0.06496815286624204 Synthia 6.369426751592356E-4 TURBOMOLE 0.0 Visualization 0.6280254777070063 X-Cell 0.001910828025477707 ZDOCK 0.028662420382165606

Year

2024 0.0 2025 0.8949975235264983 2026 1.0 2027 0.004952947003467063

Keywords

target 1.0 potential 0.3044816968867602 analysis 0.2192952446117003 docking 0.21245295928840233 visualization 0.1484775915155662 between 0.13034553540882654 novel 0.08758125213821416 promising 0.08416010947656517 energy 0.07252822442695861 binding 0.06637016763599042 cell 0.057817310981867945 performance 0.047553882996920975 activity 0.041395826205952786 stability 0.03250085528566541 strong 0.031132398221005816 including 0.024290112897707834 strategy 0.021211084502223743 synthesized 0.01573725624358536 mechanism 0.014026684912760863 therapeutic 0.008894970920287376 development 0.008552856654122478 effective 0.008552856654122478 enhanced 0.004447485460143688 experimental 0.00376325692781389 design 0.0
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