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Application

Discovery Studio 0.8326055312954876 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0639386189258312 Amorphous Cell 0.2952137376689806 Blends 0.001826817683595177 CASTEP 0.3306540007307271 CDOCKER 0.14870295944464743 CHARMm 0.23237120935330655 COMPASS 0.3423456339057362 COMPASS III 0.11618560467665327 COSMObase 0.004384362440628425 COSMOconf 0.007307270734380708 COSMOmic 0.0 COSMOperm 7.307270734380709E-4 COSMOplex 0.0 COSMOquick 3.6536353671903543E-4 COSMOtherm 0.0712458896602119 Catalyst 0.07197661673364998 Classical Simulations 1.0 Conformers 3.6536353671903543E-4 Crystallization 0.0792838874680307 DFTB Plus 0.0021921812203142127 DMol3 0.14979905005480454 DPD 0.0025575447570332483 Discover 0.003288271830471319 Forcite 0.5538911216660577 GULP 0.015710632078918523 Kinetix 3.6536353671903543E-4 LUDI 0.003653635367190354 LibDock 0.05918889294848374 LigandFit 0.0029229082937522835 MCSS 0.0 MODELER 0.21994884910485935 MesoDyn 0.0 Mesocite 0.003288271830471319 Mesoscale 0.006211180124223602 Morphology 0.018998903909389842 ONETEP 0.0014614541468761417 Polymorph 3.6536353671903543E-4 QMERA 0.0 QSAR 3.6536353671903543E-4 Quantum Mechanics 0.47351114358786994 Reflex 0.05736207526488856 Reflex Plus 3.6536353671903543E-4 Semi-empirical 0.004384362440628425 Sorption 0.058823529411764705 Synthia 0.0010960906101571063 TURBOMOLE 0.0 VAMP 0.0014614541468761417 Visualization 0.6265984654731458 X-Cell 0.0010960906101571063 ZDOCK 0.021921812203142127

Year

2024 0.2359124087591241 2025 1.0 2026 0.7693430656934307 2027 0.0

Keywords

target 1.0 potential 0.2883763837638376 analysis 0.20682656826568266 docking 0.19132841328413283 visualization 0.1437269372693727 between 0.142619926199262 promising 0.08579335793357934 energy 0.08302583025830258 novel 0.08191881918819188 cell 0.07029520295202953 binding 0.06051660516605166 performance 0.06014760147601476 stability 0.04760147601476015 activity 0.03837638376383764 enhanced 0.024907749077490774 experimental 0.01992619926199262 synthesized 0.017712177121771217 including 0.017527675276752766 mechanism 0.017527675276752766 strong 0.015498154981549815 effective 0.015129151291512915 strategy 0.014206642066420664 development 0.012177121771217712 design 0.006826568265682657 interaction 0.0
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