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Application

Discovery Studio 1.0 Materials Studio 0.5442739079102715 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0419921875 Amorphous Cell 0.2265625 Blends 9.765625E-4 CASTEP 0.1708984375 CDOCKER 0.228515625 CHARMm 0.3662109375 COMPASS 0.279296875 COMPASS III 0.103515625 COSMObase 0.001953125 COSMOconf 0.0087890625 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.060546875 Catalyst 0.1123046875 Classical Simulations 1.0 Crystallization 0.0634765625 DFTB Plus 9.765625E-4 DMol3 0.0791015625 DPD 0.001953125 Discover 0.00390625 Forcite 0.4521484375 GULP 0.0068359375 Kinetix 0.0 LUDI 0.001953125 LibDock 0.095703125 LigandFit 0.00390625 MODELER 0.3369140625 Mesocite 0.001953125 Mesoscale 0.00390625 Morphology 0.013671875 ONETEP 0.001953125 Polymorph 0.0 Quantum Mechanics 0.25 Reflex 0.0458984375 Semi-empirical 9.765625E-4 Sorption 0.052734375 Synthia 0.0 TURBOMOLE 0.0 Visualization 0.8955078125 ZDOCK 0.0390625

Year

2025 1.0 2026 0.5921052631578947 2027 0.0

Keywords

target 1.0 potential 0.35325365205843295 docking 0.3147410358565737 analysis 0.24524125719344844 visualization 0.21912350597609562 binding 0.12217795484727756 novel 0.10845506861443116 promising 0.10004426737494466 between 0.09827357237715803 activity 0.08012394864984507 therapeutic 0.06772908366533864 including 0.033200531208499334 cell 0.03275785745905268 strong 0.029659141212926073 stability 0.027445772465692783 protein 0.023019034971226208 development 0.01814962372731297 synthesized 0.01637892872952634 mechanism 0.009738822487826471 silico 0.005754758742806552 synthesis 0.0035413899955732625 effective 0.0026560424966799467 inhibition 0.0026560424966799467 interaction 8.853474988933156E-4 vitro 0.0
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