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Application

Discovery Studio 0.7876415722851432 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07628765792031098 Amorphous Cell 0.2793974732750243 Blends 0.0031584062196307093 CASTEP 0.48104956268221577 CDOCKER 0.14480077745383868 CHARMm 0.23226433430515064 COMPASS 0.4232264334305151 COMPASS III 0.04543245869776482 COSMObase 9.718172983479105E-4 COSMOconf 7.288629737609329E-4 COSMOmic 2.4295432458697764E-4 COSMOperm 0.0014577259475218659 COSMOplex 2.4295432458697764E-4 COSMOquick 0.0014577259475218659 COSMOtherm 0.06341107871720117 Catalyst 0.09766763848396501 Classical Simulations 1.0 Conformers 0.0012147716229348883 Crystallization 0.08794946550048591 DFTB Plus 0.007531584062196307 DMol3 0.22691933916423712 DPD 0.004616132167152575 Discover 0.0058309037900874635 Forcite 0.5408163265306123 GULP 0.03595724003887269 Kinetix 0.0 LUDI 0.0024295432458697765 LibDock 0.061710398445092324 LigandFit 0.004373177842565598 MCSS 7.288629737609329E-4 MODELER 0.2193877551020408 MesoDyn 0.003401360544217687 Mesocite 0.0058309037900874635 Mesoscale 0.011661807580174927 Morphology 0.018221574344023325 ONETEP 0.0012147716229348883 Polymorph 0.001943634596695821 QMERA 2.4295432458697764E-4 QSAR 0.002186588921282799 Quantum Mechanics 0.6943634596695821 Reflex 0.06778425655976676 Semi-empirical 0.010932944606413994 Sorption 0.0500485908649174 Synthia 0.001943634596695821 TURBOMOLE 7.288629737609329E-4 VAMP 0.002672497570456754 Visualization 0.6994655004859086 X-Cell 4.8590864917395527E-4 ZDOCK 0.024295432458697766

Year

2024 0.0

Keywords

target 1.0 potential 0.2550273280395999 analysis 0.17335258327317726 docking 0.171393214396205 between 0.16757760131999588 visualization 0.13818706816541199 energy 0.09281220996184388 novel 0.08765597607507476 cell 0.04784985046921728 binding 0.04516860884809735 interaction 0.04155924512735898 experimental 0.03733113334020831 activity 0.03547488914097143 promising 0.03495926575229452 stability 0.02784366298855316 mechanism 0.01928431473651645 effective 0.01825306795916263 synthesized 0.018046818603691863 development 0.008043724863359802 including 0.0060843559863875425 chemical 0.005259358564504486 synthesis 0.0034031143652676087 performance 0.002578116943384552 well 3.0937403320614623E-4 protein 0.0
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