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Application

Discovery Studio 0.6566240198101527 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0785876993166287 Amorphous Cell 0.3194760820045558 Blends 0.003986332574031891 CASTEP 0.39806378132118453 CDOCKER 0.11446469248291571 CHARMm 0.1907744874715262 COMPASS 0.4305239179954442 COMPASS III 0.0774487471526196 COSMObase 0.0011389521640091116 COSMOconf 0.003416856492027335 COSMOmic 0.0 COSMOperm 0.0 COSMOquick 0.002277904328018223 COSMOtherm 0.06093394077448747 Catalyst 0.0683371298405467 Classical Simulations 1.0 Conformers 5.694760820045558E-4 Crystallization 0.06093394077448747 DFTB Plus 0.0056947608200455585 DMol3 0.20387243735763097 DPD 0.003986332574031891 Discover 0.004555808656036446 Forcite 0.5854214123006833 GULP 0.02164009111617312 LUDI 0.003986332574031891 LibDock 0.044988610478359906 LigandFit 5.694760820045558E-4 MODELER 0.12072892938496584 MesoDyn 0.0017084282460136675 Mesocite 0.0056947608200455585 Mesoscale 0.01082004555808656 Morphology 0.015375854214123007 ONETEP 5.694760820045558E-4 Polymorph 0.0017084282460136675 QMERA 5.694760820045558E-4 Quantum Mechanics 0.5876993166287016 Reflex 0.042710706150341685 Semi-empirical 0.007972665148063782 Sorption 0.09453302961275627 Synthia 0.0011389521640091116 TURBOMOLE 0.0 VAMP 5.694760820045558E-4 Visualization 0.6167425968109339 X-Cell 0.0011389521640091116 ZDOCK 0.015945330296127564

Year

2021 0.0 2022 0.1937244201909959 2023 0.30081855388813095 2024 1.0 2025 0.9645293315143247 2026 0.3581173260572988

Keywords

higher 1.0 target 0.9474251819897547 potential 0.2167700188730116 between 0.19627932057158265 analysis 0.16985710434079265 energy 0.1493664060393637 docking 0.1401995146939876 visualization 0.1213265031005662 cell 0.06174170935562146 interaction 0.05473173362092208 performance 0.05473173362092208 novel 0.05068751685090321 binding 0.04745214343488811 stability 0.04745214343488811 activity 0.04259908331086546 experimental 0.03720679428417363 promising 0.028579131841466703 enhanced 0.027500674036128336 lower 0.023995686168778646 synthesized 0.01941224049609059 effective 0.018064168239417634 adsorption 0.01240226476139121 mechanism 0.009436505796710704 surface 8.088433540037746E-4 design 0.0
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