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Application

Discovery Studio 1.0 Materials Studio 0.9064901793339026 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.050720768820074744 Amorphous Cell 0.27229044313934864 Blends 5.339028296849973E-4 CASTEP 0.27122263747997866 CDOCKER 0.17565403096636412 CHARMm 0.2749599572877736 COMPASS 0.3358248798718633 COMPASS III 0.11158569140416444 COSMObase 0.004805125467164976 COSMOconf 0.008542445274959957 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 5.339028296849973E-4 COSMOquick 5.339028296849973E-4 COSMOtherm 0.06620395088093967 Catalyst 0.0784837159636946 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07688200747463962 DFTB Plus 0.004271222637479978 DMol3 0.12867058195408435 DPD 0.002135611318739989 Discover 0.0037373198077949813 Forcite 0.5162840363053924 GULP 0.013881473571809931 Kinetix 0.0 LUDI 0.0037373198077949813 LibDock 0.06940736785904965 LigandFit 0.003203416978109984 MODELER 0.26908702616123864 Mesocite 0.003203416978109984 Mesoscale 0.005339028296849973 Morphology 0.018152696209289908 ONETEP 0.0010678056593699946 Polymorph 0.002135611318739989 QMERA 0.0 Quantum Mechanics 0.394554191137213 Reflex 0.05392418579818473 Reflex Plus 5.339028296849973E-4 Semi-empirical 0.005339028296849973 Sorption 0.06353443673251469 Synthia 0.0010678056593699946 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7213027229044314 X-Cell 5.339028296849973E-4 ZDOCK 0.027762947143619862

Year

2024 0.08270676691729323 2025 1.0 2026 0.9306599832915622 2027 0.0

Keywords

target 1.0 potential 0.3306033306033306 docking 0.24597324597324596 analysis 0.23860223860223861 visualization 0.18263718263718265 between 0.12503412503412503 promising 0.10264810264810265 novel 0.09391209391209392 binding 0.09172809172809172 energy 0.06497406497406498 cell 0.05951405951405951 activity 0.057057057057057055 stability 0.04641004641004641 including 0.03303303303303303 performance 0.03003003003003003 strong 0.02648102648102648 synthesized 0.016926016926016925 effective 0.016653016653016654 mechanism 0.015288015288015287 development 0.014469014469014468 strategy 0.013377013377013377 therapeutic 0.012285012285012284 enhanced 0.009009009009009009 design 0.001092001092001092 protein 0.0
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