| | 1 | --------------------------------------------------------------------------- |
| | 2 | "Chimera Outreach and Training" subproject for CGL annual report |
| | 3 | |
| | 4 | reporting period is approximately June through May |
| | 5 | --------------------------------------------------------------------------- |
| | 6 | 2008/2009 report |
| | 7 | --------------------------------------------------------------------------- |
| | 8 | Jun 3, 2008 |
| | 9 | UCSF Library Course: |
| | 10 | Molecular Visualization with UCSF Chimera: Getting Started, |
| | 11 | 9-11am at the UCSF Mission Bay Campus. |
| | 12 | |
| | 13 | This session will go over the basics of molecular visualization and |
| | 14 | provide an introduction to how to use UCSF Chimera to load, visualize, |
| | 15 | and manipulate protein structures. Topics include: installing Chimera; |
| | 16 | Chimera menus and commands; fetching protein structures from ModBase |
| | 17 | and PDB; selections and actions; depictions; key tools: Side View, Model |
| | 18 | Panel, and the Selection Panel; and saving your work: sessions and images. |
| | 19 | |
| | 20 | Participants should have a basic understanding of protein structure. |
| | 21 | All participants will receive a CD with UCSF Chimera installers for Mac, |
| | 22 | PC, and Linux as well as example files and additional exercises. |
| | 23 | - Scooter Morris, Conrad Huang |
| | 24 | |
| | 25 | Jun 17, 2008 |
| | 26 | UCSF Library Course: |
| | 27 | Molecular Visualization with UCSF Chimera: Basic Tools, |
| | 28 | 9-11am at the UCSF Mission Bay Campus. |
| | 29 | |
| | 30 | This session will cover general structure visualization and analysis |
| | 31 | with Chimera. Topics include: identifying hydrogen bonds and contacts; |
| | 32 | measuring distances and angles, rotating bonds; viewing amino acid |
| | 33 | sidechain rotamers, "mutating" residues; displaying attributes such as |
| | 34 | B-factor and residue hydrophobicity; superimposing and comparing |
| | 35 | structures, morphing; viewing NMR ensembles and molecular dynamics |
| | 36 | trajectories. |
| | 37 | |
| | 38 | Participants should have an acquaintance with molecular graphics and |
| | 39 | protein structure, although expertise with Chimera is not required. |
| | 40 | Participants are encouraged to bring structures of interest (or note |
| | 41 | their Protein Data Bank IDs for retrieval in the lab) as "real-life" |
| | 42 | examples to supplement the exercises that will be provided. |
| | 43 | - Elaine Meng, Scooter Morris |
| | 44 | |
| | 45 | Jul 1, 2008 |
| | 46 | UCSF Library Course: |
| | 47 | Exploring Sequence-Structure Relationships with UCSF Chimera, |
| | 48 | 9-11am at the UCSF Mission Bay Campus. |
| | 49 | |
| | 50 | This session will cover working with protein sequence alignments together |
| | 51 | with 3D structures. Topics include: Web resources for protein family |
| | 52 | sequence alignments; sequence-structure association and crosstalk; |
| | 53 | calculating alignment conservation and displaying it on structures; |
| | 54 | using the alignment to match (superimpose) structures; matching |
| | 55 | structures without a pre-existing alignment; creating sequence alignments |
| | 56 | from multiple structure superpositions; customizing alignment appearance |
| | 57 | in Chimera; editing and saving. |
| | 58 | |
| | 59 | Participants should have at least a little experience with Chimera and |
| | 60 | a basic understanding of protein structure and sequence alignments. |
| | 61 | Participants are encouraged to bring data on systems of interest |
| | 62 | (structure IDs, and if available, corresponding sequence alignments) |
| | 63 | as "real-life" examples to supplement the exercises that will be provided. |
| | 64 | - Elaine Meng, Eric Pettersen |
| | 65 | |
| | 66 | Jul 15, 2008 |
| | 67 | UCSF Library Course: |
| | 68 | Working with EM and X-ray Density Maps in UCSF Chimera, |
| | 69 | 9-11am at the UCSF Mission Bay Campus. |
| | 70 | |
| | 71 | This session offers hands-on training for studying density maps, |
| | 72 | especially those from electron microscopy. You'll look at maps of phage |
| | 73 | K1E, a virus that infects E. coli, and learn to segment the protein coat |
| | 74 | from the packaged DNA genome, color to distinguish virus surface structures, |
| | 75 | morph to compare related viruses, and fit atomic models into the maps. |
| | 76 | The same techniques are applicable for crystallographic and tomographic |
| | 77 | density maps. Participants should have familiarity with Chimera. |
| | 78 | - Tom Goddard |
| | 79 | |
| | 80 | Jul 19, 2008 |
| | 81 | "Introduction to Molecular Visualization" tutorial at ISMB 2008 |
| | 82 | (16th Annual International Conference, Intelligent Systems for |
| | 83 | Molecular Biology, Toronto) |
| | 84 | http://www.iscb.org/ismb2008/tutorials.php |
| | 85 | Abstract: |
| | 86 | Projects such as Structural Genomics are providing increasing numbers |
| | 87 | of experimental protein and protein-complex structures. Furthermore, |
| | 88 | increasing numbers of theoretical models are being predicted from primary |
| | 89 | sequence. Biologists have an increasing need to understand and communicate |
| | 90 | the structures, functions and relationships between these protein and |
| | 91 | protein-complex structures. As a result, molecular visualization is |
| | 92 | becoming an important tool for the presentation and communication of |
| | 93 | the results of biological experiments and research. This tutorial will |
| | 94 | provide a basic foundation for the understanding of molecular structures |
| | 95 | through use of visualization tools. |
| | 96 | Attendees will learn the basics of molecular visualization and will be |
| | 97 | provided an overview of available tools and techniques for visualization, |
| | 98 | analysis and modeling of protein structure. To make these concepts more |
| | 99 | concrete, attendees will be shown the academic program UCSF Chimera in |
| | 100 | more detail, and receive instruction in its features and use. The field |
| | 101 | of structural biology is still changing, and new techniques are continually |
| | 102 | being developed. Attendees will be shown how they can add new analysis |
| | 103 | techniques and their own. |
| | 104 | - Scooter Morris, Eric Pettersen |
| | 105 | |
| | 106 | Jul 22, 2008 |
| | 107 | "StructureViz: Cytoscape and Chimera" technology track demo at ISMB 2008 |
| | 108 | (16th Annual International Conference, Intelligent Systems for |
| | 109 | Molecular Biology, Toronto) |
| | 110 | - Scooter Morris |
| | 111 | |
| | 112 | Jul 29, 2008 |
| | 113 | UCSF Library Course: |
| | 114 | Publication-Quality Images and Movies with UCSF Chimera, |
| | 115 | 9-11am at the UCSF Mission Bay Campus. |
| | 116 | |
| | 117 | This session provides hands-on training for creating images and movies of |
| | 118 | molecular models and density maps for journal articles and presentations. |
| | 119 | You'll be introduced to the myriad of options to enhance your graphics: |
| | 120 | raytracing, depth cueing, supersampling, ribbon styles, silhouette edges, |
| | 121 | subdivision level, text labels, clipping and capping, transparent or |
| | 122 | colored backgrounds, fish eye views, presets, lighting, shininess, ambient |
| | 123 | occlusion, lenticular images, and movie transitions and encoding. You'll |
| | 124 | try these techniques on your own data (downloaded or brought on a flash |
| | 125 | drive or CD) or using example data we provide. |
| | 126 | Participants should have familiarity with Chimera. |
| | 127 | - Tom Goddard, Greg Couch |
| | 128 | |
| | 129 | Jul 31, 2008 |
| | 130 | 30-minute demonstration of Cytoscape and Chimera to ~12 undergraduate |
| | 131 | students (from the organic chemistry class, University of San Francisco) |
| | 132 | - Scooter Morris, Elaine Meng |
| | 133 | |
| | 134 | Aug 5, 2008 |
| | 135 | UCSF Library Course: Customizing and tailoring UCSF Chimera, |
| | 136 | 9-11am at the UCSF Mission Bay Campus. |
| | 137 | |
| | 138 | This session will cover methods for customizing Chimera for specific tasks |
| | 139 | and projects. Topics include: writing command and demonstration scripts; |
| | 140 | accessing Chimera data structures using Python; adding per-frame actions |
| | 141 | for analyzing molecular dynamics; adding user-defined headers to sequence |
| | 142 | alignment displays; adding your own user interface elements to Chimera. |
| | 143 | |
| | 144 | Participants should have hands-on experience with Chimera. If there is a |
| | 145 | topic of particular interest, please mention it at the beginning of the |
| | 146 | session (or contact us beforehand) to ensure that we allot sufficient |
| | 147 | time to go into details. |
| | 148 | - Eric Pettersen, Conrad Huang |
| | 149 | |
| | 150 | Aug 19, 2008 |
| | 151 | UCSF Library Course: Exploring Protein Similarity Networks |
| | 152 | with Cytoscape, UCSF Chimera, and SFLD, |
| | 153 | 9-11am at the UCSF Mission Bay Campus. |
| | 154 | |
| | 155 | This session will cover the tools and methods that have been developed |
| | 156 | at UCSF to explore protein similarity networks. A protein similarity |
| | 157 | network is a network of nodes and edges where the nodes represent the |
| | 158 | protein and the edges represent some measure of the similarity between |
| | 159 | the proteins. These networks have been used to infer functional and |
| | 160 | evolutionary relationships between proteins and protein families. |
| | 161 | Session topics include: overview of protein similarity networks; using |
| | 162 | SFLDLoader to import protein similarity networks into Cytoscape; |
| | 163 | Cytoscape layouts suitable for protein similarity networks; exploring |
| | 164 | structural relationships with structureViz; creating your own protein |
| | 165 | similarity network; adding structural annotation to an existing protein |
| | 166 | similarity network. |
| | 167 | |
| | 168 | Participants should be familiar with Cytoscape and have some experience |
| | 169 | with molecular structure visualization. |
| | 170 | - Scooter Morris |
| | 171 | |
| | 172 | Nov 13, 2008 |
| | 173 | NCRR PI meeting, Bethesda, Maryland. Presentation of multiscale modeling |
| | 174 | capabilities with animations of rat brain data and Space Navigator use. |
| | 175 | - Tom Ferrin |
| | 176 | |
| | 177 | Dec 2008 |
| | 178 | Chimera used to create image for RBVI holiday card: 20S Proteasome. |
| | 179 | - Tom Goddard, Scooter Morris |
| | 180 | |
| | 181 | Dec 11, 2008 |
| | 182 | Demonstration for donors to the UCSF School of Pharmacy: |
| | 183 | visualization of the 8-segment RNA genome of influenza virus in |
| | 184 | electron microscope tomography data using special-purpose hardware: |
| | 185 | LCD stereo glasses, Space Navigator 6-degree-of-freedom input device, |
| | 186 | and Phantom force feedback input device for marker placement. |
| | 187 | - Tom Goddard |
| | 188 | |
| | 189 | Dec 12, 2008 |
| | 190 | Chimera Release Party and RBVI Open House (2-5 pm in Genentech Hall N453, |
| | 191 | UCSF Mission Bay) for local researchers and students to meet the Chimera |
| | 192 | developers, see demonstrations and discuss features, tour the RBVI |
| | 193 | facilities, and share refreshments. |
| | 194 | - Chimera team |
| | 195 | |
| | 196 | Jan 14, 2009 |
| | 197 | Chimera demonstrations for high school students participating in the |
| | 198 | Science and Education Partnership. Two half-hour demonstrations |
| | 199 | to Lincoln High School students and instructors (~18 total): |
| | 200 | viewing a nanomachine and the enzyme mevalonate kinase in stereo. |
| | 201 | - Tom Goddard |
| | 202 | |
| | 203 | Jan 23, 2009 |
| | 204 | Talk on electron tomography for Automated Molecular Imaging forum, |
| | 205 | Scripps Research Institute. |
| | 206 | - Tom Goddard |
| | 207 | |
| | 208 | Feb 1, 2009 |
| | 209 | Talk on electron tomography entitled "Interactive Visualization of Spikes, |
| | 210 | Pores and Cages" at Asia-Pacific Congress on Electron Tomography, |
| | 211 | Brisbane, Australia. http://homepage.mac.com/marshbj/APCET/ |
| | 212 | - Tom Goddard |
| | 213 | |
| | 214 | Feb 28, 2009 |
| | 215 | Presentation on current AMBER-related Chimera features and plans for |
| | 216 | further development at the AMBER developers' meeting (Feb 28-Mar 1), |
| | 217 | St. Simons Island, Georgia. |
| | 218 | - Eric Pettersen |
| | 219 | |
| | 220 | Mar 1-3, 2009 |
| | 221 | Biophysical Society 2009, Boston: |
| | 222 | RBVI staff will be giving several presentations at the NIH NCRR |
| | 223 | exhibitor booth. http://www.cgl.ucsf.edu/events/BPS2009/ |
| | 224 | - Scooter Morris, Tom Goddard |
| | 225 | |
| | 226 | Mar 31, 2009 |
| | 227 | UCSF Library Course: |
| | 228 | Molecular Visualization with UCSF Chimera: Getting Started |
| | 229 | 10am-noon at the UCSF Mission Bay Campus. |
| | 230 | http://www.library.ucsf.edu/help/classes |
| | 231 | |
| | 232 | This session will go over the basics of molecular visualization and provide |
| | 233 | an introduction to how to use UCSF Chimera to load, visualize, and manipulate |
| | 234 | protein structures. Topics include: installing Chimera; Chimera menus and |
| | 235 | commands; fetching protein structures from ModBase and PDB; selections and |
| | 236 | actions; depictions; key tools: Side View, Model Panel, and the Selection |
| | 237 | Panel; and saving your work: sessions and images. Participants should have |
| | 238 | a basic understanding of protein structure. All participants will receive |
| | 239 | a CD with UCSF Chimera installers for Mac, PC, and Linux as well as |
| | 240 | example files and additional exercises. |
| | 241 | - Scooter Morris, Conrad Huang |
| | 242 | |
| | 243 | Apr 7, 2009 |
| | 244 | UCSF Library Course: |
| | 245 | Analyzing and Comparing Structures with UCSF Chimera |
| | 246 | 10am-noon at the UCSF Mission Bay Campus. |
| | 247 | |
| | 248 | This session will cover general structure visualization and analysis |
| | 249 | with Chimera. Topics include: identifying hydrogen bonds and contacts; |
| | 250 | measuring distances and angles, rotating bonds; viewing amino acid |
| | 251 | sidechain rotamers, "mutating" residues; displaying attributes such as |
| | 252 | B-factor and residue hydrophobicity; superimposing and comparing |
| | 253 | structures, morphing; viewing NMR ensembles and molecular dynamics |
| | 254 | trajectories. Participants should have some knowledge of protein structure |
| | 255 | and molecular graphics, but expertise with Chimera is not required. |
| | 256 | Participants are encouraged to bring structures of interest (or note their |
| | 257 | Protein Data Bank IDs for retrieval in the lab) as "real-life" examples |
| | 258 | to supplement the provided exercises. |
| | 259 | - Elaine Meng |
| | 260 | |
| | 261 | Apr 14, 2009 |
| | 262 | UCSF Library Course: |
| | 263 | Exploring Sequence-Structure Relationships with UCSF Chimera |
| | 264 | 10am-noon at the UCSF Mission Bay Campus. |
| | 265 | |
| | 266 | This session will cover working with protein sequence alignments together |
| | 267 | with 3D structures. Topics include: customizing alignment appearance |
| | 268 | in Chimera; sequence-structure association and crosstalk; calculating |
| | 269 | sequence conservation and displaying it on structures; matching |
| | 270 | (superimposing) structures using an alignment; comparing structures of |
| | 271 | the same protein or different but related proteins; creating sequence |
| | 272 | alignments in Chimera; other sources of sequence alignments. Participants |
| | 273 | should have some experience using Chimera and a basic understanding of |
| | 274 | protein structure and sequence alignments. Participants are encouraged |
| | 275 | to bring data on systems of interest (structure IDs, and if available, |
| | 276 | corresponding sequence alignments) as "real-life" examples to supplement |
| | 277 | the provided exercises. |
| | 278 | - Elaine Meng, Eric Pettersen |
| | 279 | |
| | 280 | Apr 21, 2009 |
| | 281 | UCSF Library Course: |
| | 282 | Electron Microscope Tomography in UCSF Chimera |
| | 283 | 10am-noon at the UCSF Mission Bay Campus. |
| | 284 | |
| | 285 | This course provides hands-on training exploring electron tomography maps. |
| | 286 | You'll learn to trace membranes, mask and extract structures, filter |
| | 287 | data, and fit models in cellular tomograms containing microtubules, |
| | 288 | nuclear pores, vesicles and assorted subcellular structures. Chimera map |
| | 289 | capabilities are also useful for single-particle EM reconstructions |
| | 290 | and x-ray crystallography maps and researchers studying those data types |
| | 291 | may benefit from this course. Participants should have familiarity with |
| | 292 | Chimera. |
| | 293 | - Tom Goddard |
| | 294 | |
| | 295 | Apr 28, 2009 |
| | 296 | UCSF Library Course: |
| | 297 | Publication-Quality Images with UCSF Chimera |
| | 298 | 10am-noon at the UCSF Mission Bay Campus. |
| | 299 | |
| | 300 | This session provides hands-on training for creating images for journal |
| | 301 | articles and presentations. You will be introduced to the myriad of options |
| | 302 | to enhance your graphics: presets, depth cueing, transparency, silhouette |
| | 303 | edges, lighting, shininess, text labels, clipping and capping, color |
| | 304 | choices, raytracing, supersampling, subdivision quality, transparent |
| | 305 | backgrounds for image compositing, ribbon styles, stereo pairs, fish eye |
| | 306 | views, ambient occlusion, and lenticular images. Then you'll try some of |
| | 307 | these techniques on your own data (downloaded or brought on a flash drive |
| | 308 | or CD) or with example data we provide. Participants should have |
| | 309 | familiarity with Chimera. |
| | 310 | - Greg Couch |
| | 311 | |
| | 312 | May 5, 2009 |
| | 313 | UCSF Library Course: |
| | 314 | Movie Making with UCSF Chimera |
| | 315 | 10am-noon at the UCSF Mission Bay Campus. |
| | 316 | |
| | 317 | This course provides hands-on training creating movies of molecular models |
| | 318 | for journal articles and presentations. You'll create an animation showing |
| | 319 | a ligand binding to a receptor with morphing between unbound and bound |
| | 320 | states. Titling, movie encoding, animation commands, and effects (edging |
| | 321 | highlighting, shininess, smoothing) will be covered. Participants should |
| | 322 | have familiarity with Chimera. |
| | 323 | - Tom Goddard |
| | 324 | |
| | 325 | May 12, 2009 |
| | 326 | UCSF Library Course: |
| | 327 | Customizing and Tailoring UCSF Chimera |
| | 328 | 10am-noon at the UCSF Mission Bay Campus. |
| | 329 | |
| | 330 | This session will cover methods for customizing Chimera for specific tasks |
| | 331 | and projects, writing command scripts, and programming Chimera in Python. |
| | 332 | Other topics will be covered based on attendees interests. Please send |
| | 333 | mail to chimera-dev-classcgl.ucsf.edu if you would like to see a specific |
| | 334 | topic covered in depth. Possible topics include (but are not limited to): |
| | 335 | per-frame scripting of molecular dynamics trajectories; using the Demo |
| | 336 | Editor; adding user-defined headers to sequence alignments; writing |
| | 337 | Chimera extensions or commands. Participants should have hands-on |
| | 338 | experience with Chimera. |
| | 339 | - Eric Pettersen, Conrad Huang |
| | 340 | |