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Application

Discovery Studio 1.0 Materials Studio 0.9958545317505182 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0608 Amorphous Cell 0.28182857142857143 Blends 0.002285714285714286 CASTEP 0.3229714285714286 CDOCKER 0.16982857142857144 CHARMm 0.2726857142857143 COMPASS 0.33645714285714284 COMPASS III 0.10651428571428571 COSMObase 0.005257142857142857 COSMOconf 0.005942857142857143 COSMOmic 0.0 COSMOperm 4.5714285714285713E-4 COSMOplex 2.2857142857142857E-4 COSMOquick 0.0013714285714285714 COSMOtherm 0.06674285714285715 Catalyst 0.07794285714285715 Classical Simulations 1.0 Conformers 4.5714285714285713E-4 Crystallization 0.07245714285714286 DFTB Plus 0.0029714285714285715 DMol3 0.152 DPD 0.002514285714285714 Discover 0.004571428571428572 Forcite 0.5220571428571429 GULP 0.018285714285714287 Kinetix 2.2857142857142857E-4 LUDI 0.004114285714285714 LibDock 0.07062857142857143 LigandFit 0.004342857142857143 MCSS 2.2857142857142857E-4 MODELER 0.2544 MesoDyn 4.5714285714285713E-4 Mesocite 0.0032 Mesoscale 0.005942857142857143 Modules 0.0 Morphology 0.016457142857142858 ONETEP 9.142857142857143E-4 Polymorph 0.002057142857142857 QMERA 2.2857142857142857E-4 QSAR 6.857142857142857E-4 Quantum Mechanics 0.4658285714285714 Reflex 0.052571428571428575 Reflex Plus 6.857142857142857E-4 Semi-empirical 0.004571428571428572 Sorption 0.056 Synthia 9.142857142857143E-4 TURBOMOLE 0.0 VAMP 9.142857142857143E-4 Visualization 0.6971428571428572 X-Cell 0.0013714285714285714 ZDOCK 0.02857142857142857

Year

2024 0.3763844565421438 2025 1.0 2026 0.7779237844940867 2027 0.0

Keywords

target 1.0 potential 0.30986230829508565 docking 0.22276950632486286 analysis 0.21963506100973917 visualization 0.16243143400873167 between 0.14463226239785065 novel 0.09291391469830963 promising 0.08854808015224448 binding 0.07455502070972797 energy 0.07309974252770626 cell 0.06201723944923318 activity 0.04556140154483376 stability 0.04018806671890742 performance 0.03738945483040412 including 0.02294861748572708 synthesized 0.015224448673457965 effective 0.015000559722377701 strong 0.014664726295757304 development 0.014105003918056644 mechanism 0.011866114407254002 enhanced 0.010298891749692153 experimental 0.009291391469830964 interaction 0.0051494458748460765 design 0.0 strategy 0.0
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