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Application

Discovery Studio 0.7881287726358149 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06884353741496599 Amorphous Cell 0.29523809523809524 Blends 0.0021768707482993197 CASTEP 0.39510204081632655 CDOCKER 0.14122448979591837 CHARMm 0.22285714285714286 COMPASS 0.3640816326530612 COMPASS III 0.09877551020408164 COSMObase 0.004081632653061225 COSMOconf 0.006258503401360544 COSMOmic 0.0 COSMOperm 0.0010884353741496598 COSMOplex 0.0 COSMOquick 8.163265306122449E-4 COSMOtherm 0.07319727891156462 Cantera 0.0 Catalyst 0.08489795918367347 Classical Simulations 1.0 Conformers 5.442176870748299E-4 Crystallization 0.0745578231292517 DFTB Plus 0.005442176870748299 DMol3 0.17170068027210883 DPD 0.0021768707482993197 Discover 0.002993197278911565 Forcite 0.5676190476190476 GULP 0.017414965986394557 Kinetix 0.0 LUDI 0.0035374149659863946 LibDock 0.054693877551020405 LigandFit 0.0038095238095238095 MCSS 5.442176870748299E-4 MODELER 0.2127891156462585 MesoDyn 2.7210884353741496E-4 Mesocite 0.002993197278911565 Mesoscale 0.005714285714285714 Morphology 0.017959183673469388 ONETEP 0.0016326530612244899 Polymorph 8.163265306122449E-4 QMERA 0.0 QSAR 0.0010884353741496598 Quantum Mechanics 0.5589115646258503 Reflex 0.05414965986394558 Reflex Plus 5.442176870748299E-4 Semi-empirical 0.007619047619047619 Sorption 0.057414965986394555 Synthia 0.0013605442176870747 TURBOMOLE 5.442176870748299E-4 VAMP 0.0016326530612244899 Visualization 0.6691156462585034 X-Cell 0.0013605442176870747 ZDOCK 0.024217687074829932

Year

2023 0.031033153430994602 2024 0.43234387047031614 2025 1.0 2026 0.40882806476484196 2027 0.0

Keywords

target 1.0 potential 0.2791237113402062 analysis 0.19304123711340207 docking 0.18028350515463917 between 0.16121134020618558 visualization 0.15283505154639176 energy 0.09458762886597938 novel 0.08505154639175258 cell 0.06997422680412371 promising 0.06984536082474227 performance 0.05283505154639175 binding 0.05115979381443299 stability 0.040335051546391755 activity 0.04007731958762887 experimental 0.030927835051546393 synthesized 0.02422680412371134 including 0.019845360824742267 mechanism 0.01713917525773196 effective 0.017010309278350514 enhanced 0.016237113402061857 development 0.01559278350515464 interaction 0.014690721649484536 design 0.0047680412371134025 synthesis 9.020618556701031E-4 strong 0.0
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