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Application

Discovery Studio 0.9858736059479554 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05587092919031969 Amorphous Cell 0.27606812070510905 Blends 0.0014938751120406335 CASTEP 0.31102479832685986 CDOCKER 0.17269196295189723 CHARMm 0.26919629518972216 COMPASS 0.3367194502539588 COMPASS III 0.11502838362712878 COSMObase 0.0044816253361219 COSMOconf 0.005975500448162534 COSMOmic 0.0 COSMOperm 2.9877502240812666E-4 COSMOplex 2.9877502240812666E-4 COSMOquick 5.975500448162533E-4 COSMOtherm 0.06453540484015537 Catalyst 0.07588885569166418 Classical Simulations 1.0 Conformers 5.975500448162533E-4 Crystallization 0.07409620555721541 DFTB Plus 0.004182850313713774 DMol3 0.14400956080071706 DPD 0.002987750224081267 Discover 0.00358530026889752 Forcite 0.5222587391694055 GULP 0.016731401254855095 Kinetix 2.9877502240812666E-4 LUDI 0.00268897520167314 LibDock 0.06871825515386913 LigandFit 0.004182850313713774 MODELER 0.24469674335225575 MesoDyn 0.0 Mesocite 0.0032865252464893933 Mesoscale 0.005975500448162534 Modules 0.0 Morphology 0.01732895129967135 ONETEP 0.0011951000896325067 Polymorph 0.002091425156856887 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4478637585897819 Reflex 0.05318195398864655 Reflex Plus 8.9632506722438E-4 Semi-empirical 0.00537795040334628 Sorption 0.06035255452644159 Synthia 0.0014938751120406335 TURBOMOLE 0.0 VAMP 5.975500448162533E-4 Visualization 0.6880788766059157 X-Cell 8.9632506722438E-4 ZDOCK 0.027487302061547654

Year

2024 0.22855181880576528 2025 1.0 2026 0.7526881720430108 2027 0.0

Keywords

target 1.0 potential 0.308929889298893 docking 0.21918819188191882 analysis 0.2188929889298893 visualization 0.16457564575645756 between 0.14125461254612545 promising 0.09033210332103321 novel 0.08811808118081181 energy 0.07837638376383764 binding 0.0714391143911439 cell 0.06169741697416974 activity 0.04915129151291513 performance 0.04605166051660516 stability 0.04398523985239852 including 0.026863468634686347 strong 0.019630996309963098 synthesized 0.01933579335793358 effective 0.016531365313653137 development 0.015940959409594096 enhanced 0.014612546125461255 mechanism 0.013874538745387454 experimental 0.011808118081180811 strategy 0.008265682656826569 interaction 0.007675276752767528 design 0.0
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