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Application

Discovery Studio 1.0 Materials Studio 0.9864009378663541 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05810657596371882 Amorphous Cell 0.282312925170068 Blends 0.001984126984126984 CASTEP 0.31660997732426305 CDOCKER 0.1649659863945578 CHARMm 0.27267573696145125 COMPASS 0.33701814058956914 COMPASS III 0.10657596371882086 COSMObase 0.00481859410430839 COSMOconf 0.007086167800453515 COSMOmic 0.0 COSMOperm 5.668934240362812E-4 COSMOplex 2.834467120181406E-4 COSMOquick 8.503401360544217E-4 COSMOtherm 0.06604308390022676 Catalyst 0.0768140589569161 Classical Simulations 1.0 Conformers 2.834467120181406E-4 Crystallization 0.07114512471655329 DFTB Plus 0.0022675736961451248 DMol3 0.1459750566893424 DPD 0.0011337868480725624 Discover 0.004251700680272109 Forcite 0.5221088435374149 GULP 0.017573696145124718 Kinetix 0.0 LUDI 0.004251700680272109 LibDock 0.07227891156462585 LigandFit 0.0036848072562358277 MCSS 5.668934240362812E-4 MODELER 0.25510204081632654 MesoDyn 5.668934240362812E-4 Mesocite 0.0031179138321995466 Mesoscale 0.00481859410430839 Morphology 0.016439909297052153 ONETEP 5.668934240362812E-4 Polymorph 0.0017006802721088435 QMERA 0.0 QSAR 5.668934240362812E-4 Quantum Mechanics 0.45351473922902497 Reflex 0.05215419501133787 Reflex Plus 0.0 Semi-empirical 0.0036848072562358277 Sorption 0.055272108843537414 Synthia 8.503401360544217E-4 TURBOMOLE 0.0 VAMP 8.503401360544217E-4 Visualization 0.6921768707482994 X-Cell 0.0017006802721088435 ZDOCK 0.031462585034013606

Year

2024 0.2957810718358039 2025 1.0 2026 0.7958950969213227 2027 0.0

Keywords

target 1.0 potential 0.3136842105263158 docking 0.22203508771929825 analysis 0.21571929824561403 visualization 0.16042105263157894 between 0.1406315789473684 novel 0.09585964912280702 promising 0.08603508771929824 binding 0.07284210526315789 energy 0.06947368421052631 cell 0.06063157894736842 activity 0.045894736842105266 stability 0.03831578947368421 performance 0.034105263157894736 including 0.021894736842105262 strong 0.016842105263157894 development 0.014035087719298246 effective 0.013052631578947368 mechanism 0.00968421052631579 enhanced 0.008701754385964912 synthesized 0.005754385964912281 experimental 0.005333333333333333 interaction 0.002807017543859649 design 0.0 strategy 0.0
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