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Application

Discovery Studio 0.8353578770323304 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06365357311878846 Amorphous Cell 0.2938949361097965 Blends 0.002129673450070989 CASTEP 0.3393279697113109 CDOCKER 0.15002366303833412 CHARMm 0.23686701372456223 COMPASS 0.3547089446284903 COMPASS III 0.10837671557027923 COSMObase 0.005442498816848084 COSMOconf 0.00686228111689541 COSMOmic 0.0 COSMOperm 4.73260766682442E-4 COSMOplex 2.36630383341221E-4 COSMOquick 7.09891150023663E-4 COSMOtherm 0.06956933270231898 Catalyst 0.06885944155229531 Classical Simulations 1.0 Conformers 4.73260766682442E-4 Crystallization 0.07359204921911973 DFTB Plus 0.003786086133459536 DMol3 0.15830572645527685 DPD 0.002129673450070989 Discover 0.0044959772834831995 Forcite 0.5504022716516801 GULP 0.017747278750591577 Kinetix 2.36630383341221E-4 LUDI 0.0044959772834831995 LibDock 0.06247042120208235 LigandFit 0.003549455750118315 MCSS 2.36630383341221E-4 MODELER 0.22787505915759584 MesoDyn 7.09891150023663E-4 Mesocite 0.003312825366777094 Mesoscale 0.005915759583530526 Morphology 0.017274017983909134 ONETEP 9.46521533364884E-4 Polymorph 0.002129673450070989 QMERA 2.36630383341221E-4 QSAR 4.73260766682442E-4 Quantum Mechanics 0.48958826313298626 Reflex 0.05253194510175106 Reflex Plus 4.73260766682442E-4 Semi-empirical 0.005442498816848084 Sorption 0.060340747752011356 Synthia 9.46521533364884E-4 TURBOMOLE 4.73260766682442E-4 VAMP 9.46521533364884E-4 Visualization 0.6261239943208708 X-Cell 0.001893043066729768 ZDOCK 0.025082820634169428

Year

2024 0.23715928054885962 2025 1.0 2026 0.7483775264231411 2027 0.0

Keywords

target 1.0 potential 0.29423818707810995 analysis 0.20865477338476374 docking 0.1904532304725169 between 0.14525072324011573 visualization 0.1409112825458052 energy 0.08763259402121504 promising 0.0855834136933462 novel 0.08377531340405014 cell 0.06882835101253616 binding 0.05785920925747348 performance 0.055327868852459015 stability 0.0427917068466731 activity 0.03435390549662488 including 0.021697203471552556 enhanced 0.021335583413693345 experimental 0.019286403085824494 effective 0.016755062680810028 strong 0.016634522661523626 mechanism 0.01325940212150434 synthesized 0.012656702025072323 development 0.009522661523625844 strategy 0.004339440694310511 design 0.002772420443587271 interaction 0.0
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