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Application

Discovery Studio 0.7440225035161744 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05344827586206897 Amorphous Cell 0.2971264367816092 Blends 0.0022988505747126436 CASTEP 0.28218390804597704 CDOCKER 0.13620689655172413 CHARMm 0.21379310344827587 COMPASS 0.36379310344827587 COMPASS III 0.12873563218390804 COSMObase 0.0034482758620689655 COSMOconf 0.008045977011494253 COSMOmic 0.0 COSMOperm 5.747126436781609E-4 COSMOplex 5.747126436781609E-4 COSMOtherm 0.06666666666666667 Catalyst 0.06494252873563218 Classical Simulations 1.0 Conformers 5.747126436781609E-4 Crystallization 0.08160919540229886 DFTB Plus 0.004022988505747126 DMol3 0.13620689655172413 DPD 0.0017241379310344827 Discover 0.004022988505747126 Forcite 0.5655172413793104 GULP 0.01206896551724138 Kinetix 0.0 LUDI 0.0011494252873563218 LibDock 0.05344827586206897 LigandFit 0.0022988505747126436 MODELER 0.18275862068965518 Mesocite 0.004022988505747126 Mesoscale 0.005172413793103448 Morphology 0.01896551724137931 ONETEP 0.0011494252873563218 Polymorph 0.0028735632183908046 QMERA 0.0 Quantum Mechanics 0.4132183908045977 Reflex 0.058045977011494256 Reflex Plus 0.0 Semi-empirical 0.004597701149425287 Sorption 0.06896551724137931 Synthia 0.0011494252873563218 TURBOMOLE 0.0 Visualization 0.5591954022988506 X-Cell 0.0017241379310344827 ZDOCK 0.022988505747126436

Year

2024 0.0 2025 0.718013468013468 2026 1.0 2027 0.004208754208754209

Keywords

target 1.0 potential 0.2840909090909091 analysis 0.20357142857142857 docking 0.175 between 0.13733766233766234 visualization 0.12857142857142856 energy 0.09350649350649351 promising 0.08571428571428572 performance 0.07305194805194805 novel 0.07142857142857142 cell 0.07077922077922078 binding 0.04837662337662338 stability 0.038636363636363635 strategy 0.03701298701298701 strong 0.03214285714285714 activity 0.02987012987012987 including 0.023701298701298702 enhanced 0.02142857142857143 mechanism 0.02077922077922078 experimental 0.016558441558441557 effective 0.011363636363636364 design 0.010714285714285714 synthesized 0.007142857142857143 development 0.006818181818181818 efficient 0.0
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