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Application

Discovery Studio 0.8383407306247866 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06471095772217429 Amorphous Cell 0.29206212251941327 Blends 0.0025884383088869713 CASTEP 0.33908541846419327 CDOCKER 0.1494823123382226 CHARMm 0.2405090595340811 COMPASS 0.35353753235547886 COMPASS III 0.10763589301121657 COSMObase 0.005392579810181191 COSMOconf 0.006686798964624676 COSMOmic 0.0 COSMOperm 4.314063848144953E-4 COSMOplex 2.1570319240724764E-4 COSMOquick 0.0010785159620362382 COSMOtherm 0.06859361518550475 Catalyst 0.067946505608283 Classical Simulations 1.0 Conformers 4.314063848144953E-4 Crystallization 0.07312338222605695 DFTB Plus 0.004098360655737705 DMol3 0.15746333045729077 DPD 0.002372735116479724 Discover 0.004314063848144953 Forcite 0.5465918895599655 GULP 0.018334771354616048 Kinetix 2.1570319240724764E-4 LUDI 0.004098360655737705 LibDock 0.06233822260569456 LigandFit 0.003451251078515962 MCSS 2.1570319240724764E-4 MODELER 0.22648835202761 MesoDyn 6.471095772217428E-4 Mesocite 0.0032355478861087143 Mesoscale 0.0060396893874029335 Morphology 0.01639344262295082 ONETEP 8.628127696289905E-4 Polymorph 0.0021570319240724763 QMERA 2.1570319240724764E-4 QSAR 6.471095772217428E-4 Quantum Mechanics 0.4881363244176014 Reflex 0.052847282139775666 Reflex Plus 6.471095772217428E-4 Semi-empirical 0.0056082830025884385 Sorption 0.05910267471958585 Synthia 0.0010785159620362382 TURBOMOLE 4.314063848144953E-4 VAMP 8.628127696289905E-4 Visualization 0.6268334771354616 X-Cell 0.001725625539257981 ZDOCK 0.02523727351164797

Year

2024 0.2783975659229209 2025 1.0 2026 0.7046991210277215 2027 0.0

Keywords

target 1.0 potential 0.2910064473827997 analysis 0.2050049174953557 docking 0.1889410993334062 between 0.14796197136924927 visualization 0.13878264670527812 energy 0.0838159763960223 novel 0.08359742104688012 promising 0.08020981313517649 cell 0.06665938148836192 binding 0.0558408917058245 performance 0.05245328379412086 stability 0.039558518194732814 activity 0.02983280515790624 enhanced 0.018030816304229046 including 0.017375150256802536 experimental 0.015408152114523004 effective 0.014643208392525408 strong 0.011801988853677194 synthesized 0.010599934433395257 mechanism 0.010381379084253087 development 0.008632936291115724 strategy 4.371106982843405E-4 design 3.278330237132554E-4 interaction 0.0
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