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Application

Discovery Studio 1.0 Materials Studio 0.9659018483110261 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06754966887417219 Amorphous Cell 0.2747608535688006 Blends 0.002722590139808683 CASTEP 0.4160412067696836 CDOCKER 0.18042678440029433 CHARMm 0.26225165562913905 COMPASS 0.3738778513612951 COMPASS III 0.07270051508462104 COSMObase 0.0027961736571008094 COSMOconf 0.003237674760853569 COSMOmic 2.207505518763797E-4 COSMOperm 0.0012509197939661516 COSMOplex 3.679175864606328E-4 COSMOquick 0.0015452538631346578 COSMOtherm 0.06335540838852097 Cantera 7.358351729212656E-5 Catalyst 0.1224429727740986 Classical Simulations 1.0 Conformers 0.0011037527593818985 Crystallization 0.07579102281089035 DFTB Plus 0.005960264900662252 DMol3 0.19050772626931567 DPD 0.0030905077262693157 Discover 0.005003679175864606 Forcite 0.5295069904341427 GULP 0.026490066225165563 Kinetix 2.207505518763797E-4 LUDI 0.005960264900662252 LibDock 0.0725533480500368 LigandFit 0.008241353936718175 MCSS 0.0015452538631346578 MODELER 0.19514348785871966 MesoDyn 0.0015452538631346578 Mesocite 0.0041942604856512146 Mesoscale 0.007652685798381163 Modules 0.0 Morphology 0.017733627667402503 ONETEP 0.0012509197939661516 Polymorph 0.0019131714495952907 QMERA 2.207505518763797E-4 QSAR 0.0014716703458425313 Quantum Mechanics 0.5937454010301693 Reflex 0.055849889624724064 Reflex Plus 6.622516556291391E-4 Semi-empirical 0.008094186902133923 Sorption 0.05378955114054452 Synthia 0.0013980868285504047 TURBOMOLE 5.150846210448859E-4 VAMP 0.0017660044150110375 Visualization 0.8975717439293598 X-Cell 0.001177336276674025 ZDOCK 0.03142016188373804

Year

2020 0.028876280802777543 2021 0.24803116267253789 2022 0.29358963502413415 2023 0.45372173765771867 2024 1.0 2025 0.9684986027606063 2026 0.3599796765179101 2027 0.0

Keywords

target 1.0 potential 0.25758365794558785 docking 0.21501088856853665 visualization 0.21390669570284943 analysis 0.17476919301904734 between 0.14974082139680397 novel 0.09888660552709873 energy 0.07956323037757261 binding 0.06855197374474742 cell 0.0551482992362666 activity 0.051099592062080174 promising 0.04082446400637978 interaction 0.03837070208263043 synthesized 0.02671533294482103 experimental 0.02640861270435236 stability 0.02278931386682207 protein 0.019476735269760452 mechanism 0.01576542036008956 effective 0.014875931662730423 development 0.014569211422261755 synthesis 0.011900745330184339 performance 0.010827224488543999 including 0.0053676042082017 chemical 0.002024353587093212 design 0.0
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